BM										
Initial						Final				
		x	y	z				x	y	z
1FSI	N1	1.736	2.909	0.206		1FSI	N1	0.885	0.69	2.9
1FSI	S1	1.662	2.791	0.134		1FSI	S1	0.953	0.556	2.912
1FSI	S2	1.744	3.056	0.156		1FSI	S2	0.742	0.726	2.847
1FSI	O1	1.722	2.773	0.003		1FSI	O1	0.938	0.473	2.795
1FSI	O2	1.519	2.796	0.142		1FSI	O2	0.94	0.493	3.037
1FSI	O3	1.787	3.057	0.017		1FSI	O3	0.724	0.695	2.706
1FSI	O4	1.634	3.14	0.194		1FSI	O4	0.635	0.68	2.936
1FSI	F1	1.705	2.663	0.215		1FSI	F1	1.109	0.593	2.901
1FSI	F2	1.868	3.114	0.235		1FSI	F2	0.742	0.882	2.843
2FSI	N1	0.948	2.559	0.631		2FSI	N1	0.915	2.472	1.074
2FSI	S1	0.916	2.629	0.767		2FSI	S1	0.78	2.542	1.034
2FSI	S2	1.067	2.462	0.597		2FSI	S2	1.014	2.507	1.187
2FSI	O1	0.794	2.706	0.761		2FSI	O1	0.801	2.658	0.954
2FSI	O2	1.026	2.69	0.837		2FSI	O2	0.682	2.551	1.139
2FSI	O3	1.123	2.486	0.467		2FSI	O3	1.02	2.649	1.22
2FSI	O4	1.159	2.44	0.704		2FSI	O4	1.012	2.415	1.299
2FSI	F1	0.874	2.51	0.858		2FSI	F1	0.715	2.439	0.934
2FSI	F2	0.994	2.323	0.58		2FSI	F2	1.152	2.489	1.126
3FSI	N1	2.831	0.852	1.198		3FSI	N1	0.736	1.646	1.589
3FSI	S1	2.715	0.94	1.143		3FSI	S1	0.721	1.787	1.649
3FSI	S2	2.848	0.696	1.179		3FSI	S2	0.627	1.578	1.501
3FSI	O1	2.731	1.065	1.213		3FSI	O1	0.618	1.815	1.743
3FSI	O2	2.584	0.881	1.138		3FSI	O2	0.758	1.888	1.553
3FSI	O3	2.793	0.621	1.289		3FSI	O3	0.506	1.535	1.567
3FSI	O4	2.823	0.651	1.045		3FSI	O4	0.614	1.648	1.376
3FSI	F1	2.756	0.972	0.994		3FSI	F1	0.844	1.782	1.75
3FSI	F2	3.003	0.678	1.194		3FSI	F2	0.697	1.437	1.466
4FSI	N1	0.78	0.542	1.057		4FSI	N1	1.346	2.973	1.364
4FSI	S1	0.651	0.624	1.091		4FSI	S1	1.328	3.127	1.363
4FSI	S2	0.817	0.399	1.104		4FSI	S2	1.248	2.867	1.426
4FSI	O1	0.639	0.741	1.01		4FSI	O1	1.394	3.205	1.466
4FSI	O2	0.628	0.639	1.232		4FSI	O2	1.202	3.176	1.314
4FSI	O3	0.959	0.38	1.116		4FSI	O3	1.236	2.862	1.571
4FSI	O4	0.734	0.343	1.208		4FSI	O4	1.124	2.858	1.355
4FSI	F1	0.534	0.531	1.04		4FSI	F1	1.417	3.165	1.239
4FSI	F2	0.779	0.314	0.977		4FSI	F2	1.328	2.746	1.389
5FSI	N1	0.542	1.529	2.905		5FSI	N1	0.425	1.879	2.267
5FSI	S1	0.559	1.646	2.803		5FSI	S1	0.41	1.96	2.137
5FSI	S2	0.559	1.374	2.886		5FSI	S2	0.393	1.731	2.287
5FSI	O1	0.463	1.647	2.695		5FSI	O1	0.273	1.984	2.1
5FSI	O2	0.695	1.68	2.772		5FSI	O2	0.507	1.919	2.034
5FSI	O3	0.474	1.318	2.784		5FSI	O3	0.266	1.709	2.354
5FSI	O4	0.694	1.325	2.897		5FSI	O4	0.414	1.641	2.182
5FSI	F1	0.511	1.767	2.891		5FSI	F1	0.462	2.103	2.174
5FSI	F2	0.492	1.321	3.018		5FSI	F2	0.491	1.684	2.395
6FSI	N1	0.881	1.885	0.097		6FSI	N1	0.358	1.965	0.528
6FSI	S1	0.82	2.008	0.021		6FSI	S1	0.311	1.912	0.389
6FSI	S2	0.992	1.88	0.208		6FSI	S2	0.506	2.011	0.569
6FSI	O1	0.887	2.042	-0.104		6FSI	O1	0.349	1.775	0.363
6FSI	O2	0.776	2.116	0.104		6FSI	O2	0.32	2.008	0.282
6FSI	O3	1.003	1.749	0.269		6FSI	O3	0.594	1.901	0.593
6FSI	O4	1.115	1.944	0.171		6FSI	O4	0.554	2.116	0.486
6FSI	F1	0.684	1.948	-0.031		6FSI	F1	0.157	1.889	0.415
6FSI	F2	0.934	1.97	0.324		6FSI	F2	0.488	2.078	0.71
7FSI	N1	0.295	0.114	0.668		7FSI	N1	0.233	2.773	1.053
7FSI	S1	0.338	0.084	0.521		7FSI	S1	0.28	2.635	1.105
7FSI	S2	0.157	0.082	0.734		7FSI	S2	0.179	2.896	1.134
7FSI	O1	0.243	0.141	0.428		7FSI	O1	0.184	2.559	1.175
7FSI	O2	0.383	-0.05	0.497		7FSI	O2	0.405	2.645	1.171
7FSI	O3	0.049	0.118	0.644		7FSI	O3	0.069	2.86	1.223
7FSI	O4	0.151	-0.045	0.803		7FSI	O4	0.274	2.986	1.192
7FSI	F1	0.468	0.171	0.501		7FSI	F1	0.308	2.543	0.974
7FSI	F2	0.149	0.188	0.849		7FSI	F2	0.121	2.992	1.02
8FSI	N1	0.502	3.021	1.084		8FSI	N1	0.703	2.982	1.44
8FSI	S1	0.572	3.003	1.221		8FSI	S1	0.748	2.847	1.372
8FSI	S2	0.461	2.915	0.98		8FSI	S2	0.639	3.108	1.375
8FSI	O1	0.637	3.126	1.259		8FSI	O1	0.857	2.858	1.278
8FSI	O2	0.647	2.881	1.236		8FSI	O2	0.635	2.772	1.323
8FSI	O3	0.564	2.822	0.939		8FSI	O3	0.731	3.183	1.29
8FSI	O4	0.328	2.865	0.998		8FSI	O4	0.509	3.084	1.327
8FSI	F1	0.453	2.991	1.324		8FSI	F1	0.808	2.755	1.489
8FSI	F2	0.444	3.003	0.852		8FSI	F2	0.613	3.198	1.496
9FSI	N1	1.805	0.601	3.042		9FSI	N1	0.276	0.461	2.755
9FSI	S1	1.829	0.722	2.946		9FSI	S1	0.273	0.451	2.91
9FSI	S2	1.726	0.47	3.011		9FSI	S2	0.4	0.426	2.668
9FSI	O1	1.731	0.826	2.955		9FSI	O1	0.342	0.559	2.977
9FSI	O2	1.867	0.675	2.814		9FSI	O2	0.278	0.317	2.959
9FSI	O3	1.584	0.479	3.034		9FSI	O3	0.491	0.539	2.674
9FSI	O4	1.771	0.414	2.885		9FSI	O4	0.453	0.291	2.671
9FSI	F1	1.96	0.787	3.004		9FSI	F1	0.12	0.486	2.933
9FSI	F2	1.778	0.369	3.12		9FSI	F2	0.337	0.43	2.524
10FSI	N1	1.266	0.15	2.304		10FSI	N1	0.278	0.893	2.743
10FSI	S1	1.388	0.077	2.369		10FSI	S1	0.397	0.937	2.65
10FSI	S2	1.116	0.134	2.343		10FSI	S2	0.272	0.895	2.895
10FSI	O1	1.422	-0.049	2.309		10FSI	O1	0.498	0.837	2.636
10FSI	O2	1.38	0.085	2.514		10FSI	O2	0.442	1.073	2.665
10FSI	O3	1.039	0.047	2.258		10FSI	O3	0.378	0.826	2.958
10FSI	O4	1.102	0.116	2.486		10FSI	O4	0.24	1.025	2.953
10FSI	F1	1.509	0.171	2.332		10FSI	F1	0.326	0.946	2.507
10FSI	F2	1.056	0.277	2.317		10FSI	F2	0.147	0.807	2.913
11FSI	N1	2.258	2.812	1.792		11FSI	N1	1.265	0.153	2.517
11FSI	S1	2.232	2.741	1.654		11FSI	S1	1.189	0.182	2.653
11FSI	S2	2.395	2.849	1.861		11FSI	S2	1.218	0.077	2.388
11FSI	O1	2.111	2.658	1.653		11FSI	O1	1.193	0.076	2.745
11FSI	O2	2.345	2.685	1.587		11FSI	O2	1.068	0.258	2.644
11FSI	O3	2.463	2.743	1.934		11FSI	O3	1.212	-0.068	2.397
11FSI	O4	2.475	2.942	1.787		11FSI	O4	1.106	0.147	2.321
11FSI	F1	2.189	2.862	1.563		11FSI	F1	1.294	0.283	2.717
11FSI	F2	2.34	2.939	1.979		11FSI	F2	1.331	0.111	2.284
12FSI	N1	0.671	1.079	2.141		12FSI	N1	0.747	1.189	2.973
12FSI	S1	0.704	1.229	2.114		12FSI	S1	0.757	1.303	2.866
12FSI	S2	0.665	0.963	2.037		12FSI	S2	0.639	1.152	3.077
12FSI	O1	0.587	1.313	2.111		12FSI	O1	0.783	1.438	2.915
12FSI	O2	0.807	1.253	2.017		12FSI	O2	0.644	1.285	2.777
12FSI	O3	0.566	0.981	1.934		12FSI	O3	0.667	1.21	3.204
12FSI	O4	0.795	0.913	2.001		12FSI	O4	0.506	1.146	3.031
12FSI	F1	0.772	1.271	2.249		12FSI	F1	0.886	1.271	2.77
12FSI	F2	0.605	0.845	2.121		12FSI	F2	0.675	1.005	3.106
13FSI	N1	2.273	0.569	0.41		13FSI	N1	0.635	0.397	2.373
13FSI	S1	2.33	0.696	0.484		13FSI	S1	0.76	0.33	2.434
13FSI	S2	2.309	0.418	0.43		13FSI	S2	0.634	0.537	2.313
13FSI	O1	2.461	0.736	0.441		13FSI	O1	0.792	0.386	2.568
13FSI	O2	2.3	0.702	0.625		13FSI	O2	0.865	0.303	2.337
13FSI	O3	2.448	0.386	0.406		13FSI	O3	0.617	0.634	2.418
13FSI	O4	2.242	0.353	0.54		13FSI	O4	0.732	0.566	2.209
13FSI	F1	2.238	0.809	0.425		13FSI	F1	0.703	0.192	2.479
13FSI	F2	2.238	0.354	0.305		13FSI	F2	0.493	0.537	2.23
14FSI	N1	0.082	2.358	2.698		14FSI	N1	0.797	2.58	2.803
14FSI	S1	0.157	2.272	2.804		14FSI	S1	0.66	2.633	2.841
14FSI	S2	0.057	2.512	2.7		14FSI	S2	0.827	2.448	2.73
14FSI	O1	0.072	2.209	2.901		14FSI	O1	0.633	2.622	2.983
14FSI	O2	0.277	2.339	2.849		14FSI	O2	0.555	2.607	2.746
14FSI	O3	-0.063	2.552	2.769		14FSI	O3	0.76	2.334	2.792
14FSI	O4	0.18	2.582	2.728		14FSI	O4	0.831	2.445	2.586
14FSI	F1	0.211	2.152	2.719		14FSI	F1	0.681	2.786	2.821
14FSI	F2	0.026	2.546	2.549		14FSI	F2	0.976	2.425	2.771
15FSI	N1	0.51	2.206	2.635		15FSI	N1	0.24	2.523	0.025
15FSI	S1	0.497	2.333	2.545		15FSI	S1	0.332	2.444	0.121
15FSI	S2	0.604	2.082	2.618		15FSI	S2	0.188	2.474	-0.112
15FSI	O1	0.426	2.437	2.616		15FSI	O1	0.467	2.481	0.116
15FSI	O2	0.458	2.306	2.41		15FSI	O2	0.304	2.303	0.129
15FSI	O3	0.619	2.032	2.483		15FSI	O3	0.285	2.474	-0.215
15FSI	O4	0.724	2.091	2.698		15FSI	O4	0.1	2.363	-0.092
15FSI	F1	0.645	2.387	2.535		15FSI	F1	0.29	2.501	0.262
15FSI	F2	0.521	1.969	2.69		15FSI	F2	0.085	2.587	-0.158
16FSI	N1	0.478	2.058	2.027		16FSI	N1	0.373	2.231	2.433
16FSI	S1	0.388	1.994	2.138		16FSI	S1	0.505	2.257	2.514
16FSI	S2	0.597	1.994	1.948		16FSI	S2	0.288	2.334	2.35
16FSI	O1	0.463	1.956	2.256		16FSI	O1	0.474	2.35	2.623
16FSI	O2	0.289	1.902	2.091		16FSI	O2	0.628	2.277	2.435
16FSI	O3	0.677	1.907	2.03		16FSI	O3	0.204	2.417	2.441
16FSI	O4	0.565	1.952	1.814		16FSI	O4	0.349	2.399	2.236
16FSI	F1	0.302	2.117	2.187		16FSI	F1	0.532	2.112	2.583
16FSI	F2	0.692	2.118	1.924		16FSI	F2	0.184	2.241	2.281
17FSI	N1	1.694	2.65	1.322		17FSI	N1	1.338	2.728	2.084
17FSI	S1	1.748	2.513	1.373		17FSI	S1	1.251	2.629	2.166
17FSI	S2	1.553	2.713	1.346		17FSI	S2	1.286	2.851	1.999
17FSI	O1	1.649	2.411	1.393		17FSI	O1	1.13	2.599	2.091
17FSI	O2	1.852	2.528	1.474		17FSI	O2	1.238	2.674	2.303
17FSI	O3	1.448	2.649	1.272		17FSI	O3	1.26	2.815	1.863
17FSI	O4	1.528	2.743	1.484		17FSI	O4	1.203	2.949	2.068
17FSI	F1	1.828	2.462	1.247		17FSI	F1	1.333	2.505	2.167
17FSI	F2	1.566	2.855	1.28		17FSI	F2	1.416	2.938	1.975
18FSI	N1	1.354	1.74	0.637		18FSI	N1	0.85	1.581	0.496
18FSI	S1	1.302	1.761	0.49		18FSI	S1	0.782	1.563	0.358
18FSI	S2	1.499	1.715	0.687		18FSI	S2	0.783	1.575	0.638
18FSI	O1	1.214	1.659	0.441		18FSI	O1	0.65	1.627	0.346
18FSI	O2	1.407	1.805	0.401		18FSI	O2	0.795	1.423	0.317
18FSI	O3	1.534	1.576	0.708		18FSI	O3	0.77	1.699	0.706
18FSI	O4	1.597	1.793	0.615		18FSI	O4	0.679	1.474	0.65
18FSI	F1	1.207	1.886	0.504		18FSI	F1	0.878	1.643	0.26
18FSI	F2	1.499	1.778	0.831		18FSI	F2	0.896	1.513	0.72
19FSI	N1	0.526	0.135	2.107		19FSI	N1	0.152	1.474	2.788
19FSI	S1	0.455	0.003	2.064		19FSI	S1	0.199	1.619	2.769
19FSI	S2	0.676	0.175	2.089		19FSI	S2	0.244	1.345	2.795
19FSI	O1	0.452	-0.095	2.17		19FSI	O1	0.203	1.662	2.634
19FSI	O2	0.489	-0.043	1.932		19FSI	O2	0.303	1.657	2.86
19FSI	O3	0.768	0.083	2.154		19FSI	O3	0.351	1.342	2.697
19FSI	O4	0.712	0.222	1.958		19FSI	O4	0.274	1.303	2.928
19FSI	F1	0.305	0.048	2.052		19FSI	F1	0.084	1.7	2.832
19FSI	F2	0.686	0.303	2.179		19FSI	F2	0.145	1.238	2.747
20FSI	N1	2.343	0.3	1.768		20FSI	N1	2.275	2.88	1.407
20FSI	S1	2.401	0.435	1.714		20FSI	S1	2.296	2.751	1.495
20FSI	S2	2.224	0.216	1.711		20FSI	S2	2.208	3.018	1.442
20FSI	O1	2.313	0.548	1.728		20FSI	O1	2.178	2.702	1.564
20FSI	O2	2.474	0.422	1.589		20FSI	O2	2.422	2.756	1.566
20FSI	O3	2.154	0.137	1.81		20FSI	O3	2.067	3.016	1.415
20FSI	O4	2.141	0.283	1.615		20FSI	O4	2.249	3.084	1.565
20FSI	F1	2.516	0.466	1.818		20FSI	F1	2.318	2.639	1.388
20FSI	F2	2.297	0.106	1.626		20FSI	F2	2.265	3.116	1.335
21FSI	N1	1.633	1.433	0.352		21FSI	N1	0.309	1.246	0.407
21FSI	S1	1.528	1.355	0.436		21FSI	S1	0.302	1.151	0.286
21FSI	S2	1.722	1.551	0.402		21FSI	S2	0.425	1.343	0.453
21FSI	O1	1.405	1.427	0.453		21FSI	O1	0.396	1.042	0.299
21FSI	O2	1.586	1.305	0.559		21FSI	O2	0.288	1.205	0.156
21FSI	O3	1.672	1.681	0.366		21FSI	O3	0.558	1.3	0.408
21FSI	O4	1.762	1.532	0.539		21FSI	O4	0.403	1.485	0.442
21FSI	F1	1.492	1.229	0.349		21FSI	F1	0.165	1.077	0.32
21FSI	F2	1.855	1.536	0.318		21FSI	F2	0.419	1.33	0.612
22FSI	N1	0.126	0.027	1.322		22FSI	N1	2.751	0.106	1.433
22FSI	S1	0.023	-0.034	1.221		22FSI	S1	2.878	0.166	1.496
22FSI	S2	0.098	0.131	1.436		22FSI	S2	2.727	-0.047	1.396
22FSI	O1	0.078	-0.048	1.088		22FSI	O1	2.988	0.173	1.406
22FSI	O2	-0.112	0.012	1.232		22FSI	O2	2.908	0.11	1.627
22FSI	O3	0.067	0.263	1.389		22FSI	O3	2.844	-0.114	1.34
22FSI	O4	0.02	0.078	1.546		22FSI	O4	2.664	-0.117	1.51
22FSI	F1	0.016	-0.183	1.268		22FSI	F1	2.831	0.312	1.525
22FSI	F2	0.242	0.148	1.5		22FSI	F2	2.615	-0.049	1.283
23FSI	N1	0.65	2.004	0.986		23FSI	N1	3.037	2.872	2.096
23FSI	S1	0.493	2.001	0.979		23FSI	S1	3.153	2.875	2.197
23FSI	S2	0.747	1.918	1.073		23FSI	S2	2.964	2.982	2.015
23FSI	O1	0.427	2.073	1.086		23FSI	O1	3.129	2.963	2.307
23FSI	O2	0.435	1.877	0.935		23FSI	O2	3.287	2.873	2.143
23FSI	O3	0.775	1.976	1.202		23FSI	O3	2.898	3.083	2.089
23FSI	O4	0.727	1.776	1.065		23FSI	O4	3.029	3.025	1.896
23FSI	F1	0.467	2.096	0.856		23FSI	F1	3.143	2.735	2.258
23FSI	F2	0.884	1.937	0.997		23FSI	F2	2.841	2.9	1.952
24FSI	N1	1.417	1.265	1.763		24FSI	N1	1.55	0.273	1.904
24FSI	S1	1.542	1.338	1.706		24FSI	S1	1.553	0.182	1.782
24FSI	S2	1.27	1.313	1.748		24FSI	S2	1.67	0.32	1.993
24FSI	O1	1.643	1.371	1.804		24FSI	O1	1.614	0.052	1.799
24FSI	O2	1.51	1.436	1.605		24FSI	O2	1.572	0.254	1.654
24FSI	O3	1.232	1.417	1.84		24FSI	O3	1.731	0.216	2.083
24FSI	O4	1.238	1.334	1.609		24FSI	O4	1.766	0.393	1.915
24FSI	F1	1.609	1.221	1.624		24FSI	F1	1.401	0.146	1.767
24FSI	F2	1.186	1.188	1.79		24FSI	F2	1.606	0.422	2.097
25FSI	N1	1.438	1.261	1.13		25FSI	N1	1.86	0.405	1.405
25FSI	S1	1.5	1.257	1.273		25FSI	S1	1.713	0.454	1.382
25FSI	S2	1.288	1.237	1.091		25FSI	S2	1.902	0.301	1.513
25FSI	O1	1.412	1.307	1.376		25FSI	O1	1.686	0.58	1.447
25FSI	O2	1.636	1.304	1.276		25FSI	O2	1.608	0.355	1.384
25FSI	O3	1.266	1.249	0.95		25FSI	O3	1.883	0.359	1.644
25FSI	O4	1.227	1.125	1.16		25FSI	O4	1.857	0.163	1.49
25FSI	F1	1.514	1.103	1.302		25FSI	F1	1.72	0.503	1.232
25FSI	F2	1.216	1.363	1.151		25FSI	F2	2.053	0.291	1.5
26FSI	N1	2.861	2.773	0.381		26FSI	N1	2.942	2.639	1.687
26FSI	S1	2.99	2.82	0.456		26FSI	S1	2.787	2.592	1.675
26FSI	S2	2.845	2.703	0.242		26FSI	S2	3.021	2.743	1.595
26FSI	O1	3.064	2.927	0.395		26FSI	O1	2.76	2.482	1.585
26FSI	O2	3.062	2.707	0.513		26FSI	O2	2.686	2.694	1.671
26FSI	O3	2.781	2.784	0.142		26FSI	O3	3.007	2.717	1.452
26FSI	O4	2.957	2.622	0.202		26FSI	O4	3.006	2.878	1.64
26FSI	F1	2.93	2.888	0.584		26FSI	F1	2.76	2.531	1.823
26FSI	F2	2.734	2.595	0.274		26FSI	F2	3.175	2.715	1.625
27FSI	N1	2.643	1.873	1.153		27FSI	N1	0.648	2.03	1.084
27FSI	S1	2.729	1.923	1.273		27FSI	S1	0.592	1.9	1.022
27FSI	S2	2.554	1.745	1.15		27FSI	S2	0.774	2.054	1.175
27FSI	O1	2.829	1.823	1.302		27FSI	O1	0.588	1.789	1.118
27FSI	O2	2.654	1.98	1.38		27FSI	O2	0.641	1.874	0.889
27FSI	O3	2.631	1.633	1.199		27FSI	O3	0.731	2.084	1.311
27FSI	O4	2.419	1.764	1.197		27FSI	O4	0.873	1.953	1.166
27FSI	F1	2.811	2.044	1.213		27FSI	F1	0.446	1.946	1
27FSI	F2	2.538	1.716	0.997		27FSI	F2	0.846	2.182	1.117
28FSI	N1	0.566	2.356	1.514		28FSI	N1	0.749	2.713	2.159
28FSI	S1	0.553	2.215	1.449		28FSI	S1	0.603	2.724	2.107
28FSI	S2	0.499	2.407	1.646		28FSI	S2	0.787	2.66	2.301
28FSI	O1	0.446	2.207	1.351		28FSI	O1	0.537	2.848	2.144
28FSI	O2	0.568	2.104	1.541		28FSI	O2	0.524	2.605	2.107
28FSI	O3	0.356	2.399	1.643		28FSI	O3	0.719	2.724	2.407
28FSI	O4	0.567	2.365	1.765		28FSI	O4	0.795	2.517	2.306
28FSI	F1	0.683	2.209	1.362		28FSI	F1	0.635	2.745	1.957
28FSI	F2	0.527	2.561	1.64		28FSI	F2	0.934	2.705	2.32
29FSI	N1	0.335	1.716	1.384		29FSI	N1	0.596	2.293	1.783
29FSI	S1	0.486	1.744	1.417		29FSI	S1	0.649	2.292	1.931
29FSI	S2	0.245	1.593	1.421		29FSI	S2	0.534	2.171	1.704
29FSI	O1	0.577	1.636	1.392		29FSI	O1	0.719	2.166	1.964
29FSI	O2	0.505	1.823	1.538		29FSI	O2	0.553	2.349	2.022
29FSI	O3	0.218	1.502	1.313		29FSI	O3	0.624	2.13	1.601
29FSI	O4	0.267	1.538	1.552		29FSI	O4	0.48	2.067	1.782
29FSI	F1	0.521	1.849	1.305		29FSI	F1	0.759	2.398	1.931
29FSI	F2	0.104	1.663	1.438		29FSI	F2	0.408	2.233	1.631
30FSI	N1	0.161	2.505	0.994		30FSI	N1	0.39	0.053	1.68
30FSI	S1	0.075	2.599	0.902		30FSI	S1	0.262	0.101	1.615
30FSI	S2	0.148	2.35	1.016		30FSI	S2	0.406	-0.083	1.763
30FSI	O1	0.078	2.562	0.762		30FSI	O1	0.142	0.075	1.692
30FSI	O2	0.091	2.74	0.929		30FSI	O2	0.259	0.077	1.473
30FSI	O3	0.239	2.298	1.117		30FSI	O3	0.368	-0.069	1.901
30FSI	O4	0.014	2.3	1.018		30FSI	O4	0.346	-0.192	1.686
30FSI	F1	-0.073	2.573	0.945		30FSI	F1	0.271	0.257	1.624
30FSI	F2	0.207	2.292	0.881		30FSI	F2	0.565	-0.101	1.761
31BM	C1	1.11	1.059	0.473		31BM	C1	2.665	0.272	0.924
31BM	H1	1.182	1.141	0.468		31BM	H1	2.673	0.371	0.97
31BM	H2	1.164	0.969	0.501		31BM	H2	2.741	0.275	0.845
31BM	C2	1.041	1.039	0.338		31BM	C2	2.521	0.25	0.871
31BM	H3	0.975	0.952	0.344		31BM	H3	2.449	0.248	0.952
31BM	H4	0.976	1.124	0.319		31BM	H4	2.499	0.324	0.794
31BM	C3	1.14	1.021	0.221		31BM	C3	2.516	0.109	0.797
31BM	O1	1.009	1.089	0.568		31BM	O1	2.697	0.17	1.016
31BM	C4	1.059	1.105	0.699		31BM	C4	2.818	0.195	1.088
31BM	H5	1.131	1.186	0.705		31BM	H5	2.82	0.297	1.128
31BM	H6	0.977	1.127	0.768		31BM	H6	2.834	0.122	1.168
31BM	H7	1.108	1.013	0.734		31BM	H7	2.9	0.176	1.018
31BM	H8	1.202	0.934	0.237		31BM	H8	2.539	0.027	0.864
31BM	H9	1.21	1.104	0.218		31BM	H9	2.59	0.111	0.717
31BM	C5	1.069	1.008	0.086		31BM	C5	2.374	0.08	0.744
31BM	H10	1.01	1.097	0.063		31BM	H10	2.294	0.109	0.812
31BM	H11	1.141	0.994	0.006		31BM	H11	2.367	0.131	0.648
31BM	H12	1.002	0.922	0.086		31BM	H12	2.374	-0.024	0.711
32BM	C1	0.883	2.709	1.402		32BM	C1	2.676	1.117	1.536
32BM	H1	0.983	2.687	1.439		32BM	H1	2.764	1.174	1.567
32BM	H2	0.883	2.811	1.364		32BM	H2	2.679	1.107	1.427
32BM	C2	0.779	2.699	1.514		32BM	C2	2.553	1.205	1.566
32BM	H3	0.682	2.726	1.473		32BM	H3	2.566	1.3	1.514
32BM	H4	0.77	2.595	1.545		32BM	H4	2.465	1.152	1.533
32BM	C3	0.814	2.79	1.633		32BM	C3	2.544	1.233	1.716
32BM	O1	0.851	2.617	1.299		32BM	O1	2.654	0.986	1.589
32BM	C4	0.904	2.655	1.173		32BM	C4	2.753	0.891	1.554
32BM	H5	1.013	2.665	1.176		32BM	H5	2.78	0.878	1.449
32BM	H6	0.88	2.578	1.1		32BM	H6	2.836	0.905	1.623
32BM	H7	0.861	2.748	1.138		32BM	H7	2.721	0.789	1.576
32BM	H8	0.83	2.892	1.596		32BM	H8	2.644	1.264	1.747
32BM	H9	0.907	2.757	1.678		32BM	H9	2.514	1.148	1.777
32BM	C5	0.706	2.794	1.741		32BM	C5	2.432	1.339	1.739
32BM	H10	0.693	2.697	1.788		32BM	H10	2.403	1.357	1.842
32BM	H11	0.731	2.866	1.82		32BM	H11	2.461	1.434	1.695
32BM	H12	0.609	2.825	1.7		32BM	H12	2.34	1.306	1.692
33BM	C1	0.923	2.763	2.285		33BM	C1	1.233	1.745	0.895
33BM	H1	0.892	2.694	2.364		33BM	H1	1.341	1.734	0.906
33BM	H2	0.897	2.718	2.189		33BM	H2	1.217	1.779	0.793
33BM	C2	1.075	2.784	2.295		33BM	C2	1.197	1.857	0.99
33BM	H3	1.109	2.848	2.214		33BM	H3	1.089	1.872	0.98
33BM	H4	1.098	2.836	2.388		33BM	H4	1.196	1.832	1.096
33BM	C3	1.152	2.651	2.29		33BM	C3	1.279	1.987	0.958
33BM	O1	0.856	2.888	2.3		33BM	O1	1.166	1.628	0.934
33BM	C4	0.717	2.869	2.32		33BM	C4	1.216	1.517	0.857
33BM	H5	0.696	2.81	2.409		33BM	H5	1.192	1.532	0.751
33BM	H6	0.665	2.964	2.333		33BM	H6	1.323	1.497	0.861
33BM	H7	0.671	2.819	2.234		33BM	H7	1.16	1.428	0.885
33BM	H8	1.133	2.601	2.195		33BM	H8	1.274	1.998	0.85
33BM	H9	1.115	2.583	2.367		33BM	H9	1.379	1.959	0.991
33BM	C5	1.303	2.671	2.309		33BM	C5	1.251	2.111	1.038
33BM	H10	1.326	2.713	2.407		33BM	H10	1.267	2.099	1.145
33BM	H11	1.355	2.575	2.299		33BM	H11	1.307	2.194	0.995
33BM	H12	1.343	2.738	2.234		33BM	H12	1.144	2.127	1.027
34BM	C1	2.501	1.288	2.772		34BM	C1	0.402	0.762	0.713
34BM	H1	2.546	1.364	2.707		34BM	H1	0.496	0.709	0.698
34BM	H2	2.518	1.319	2.876		34BM	H2	0.376	0.795	0.613
34BM	C2	2.566	1.152	2.748		34BM	C2	0.426	0.89	0.799
34BM	H3	2.525	1.08	2.82		34BM	H3	0.327	0.933	0.816
34BM	H4	2.538	1.115	2.649		34BM	H4	0.469	0.866	0.896
34BM	C3	2.719	1.157	2.76		34BM	C3	0.493	1.014	0.731
34BM	O1	2.363	1.277	2.746		34BM	O1	0.296	0.684	0.771
34BM	C4	2.29	1.395	2.774		34BM	C4	0.248	0.588	0.666
34BM	H5	2.326	1.48	2.715		34BM	H5	0.326	0.512	0.663
34BM	H6	2.185	1.38	2.75		34BM	H6	0.161	0.535	0.703
34BM	H7	2.297	1.421	2.88		34BM	H7	0.244	0.618	0.561
34BM	H8	2.748	1.2	2.856		34BM	H8	0.447	1.065	0.646
34BM	H9	2.76	1.221	2.682		34BM	H9	0.59	0.977	0.698
34BM	C5	2.783	1.018	2.747		34BM	C5	0.528	1.124	0.828
34BM	H10	2.756	0.969	2.654		34BM	H10	0.62	1.094	0.879
34BM	H11	2.892	1.026	2.75		34BM	H11	0.546	1.216	0.774
34BM	H12	2.754	0.953	2.83		34BM	H12	0.45	1.148	0.9
35BM	C1	2.455	0.629	0.091		35BM	C1	1.526	1.203	0.037
35BM	H1	2.409	0.583	0.004		35BM	H1	1.465	1.205	0.127
35BM	H2	2.42	0.572	0.177		35BM	H2	1.477	1.157	-0.049
35BM	C2	2.415	0.776	0.101		35BM	C2	1.64	1.11	0.076
35BM	H3	2.459	0.818	0.192		35BM	H3	1.709	1.124	-0.008
35BM	H4	2.458	0.832	0.018		35BM	H4	1.697	1.151	0.16
35BM	C3	2.263	0.796	0.104		35BM	C3	1.599	0.965	0.086
35BM	O1	2.596	0.619	0.076		35BM	O1	1.572	1.336	0.012
35BM	C4	2.664	0.605	0.2		35BM	C4	1.468	1.421	-0.039
35BM	H5	2.636	0.513	0.25		35BM	H5	1.495	1.526	-0.051
35BM	H6	2.772	0.604	0.184		35BM	H6	1.437	1.399	-0.141
35BM	H7	2.643	0.688	0.268		35BM	H7	1.384	1.41	0.029
35BM	H8	2.219	0.729	0.178		35BM	H8	1.586	0.923	-0.013
35BM	H9	2.221	0.767	0.008		35BM	H9	1.499	0.959	0.13
35BM	C5	2.222	0.94	0.137		35BM	C5	1.701	0.879	0.164
35BM	H10	2.262	1.01	0.064		35BM	H10	1.727	0.924	0.26
35BM	H11	2.113	0.95	0.139		35BM	H11	1.663	0.78	0.186
35BM	H12	2.259	0.97	0.235		35BM	H12	1.794	0.867	0.108
36BM	C1	2.676	1.132	0.716		36BM	C1	1.661	1.409	2.12
36BM	H1	2.707	1.163	0.616		36BM	H1	1.557	1.385	2.143
36BM	H2	2.707	1.028	0.73		36BM	H2	1.67	1.397	2.012
36BM	C2	2.525	1.144	0.731		36BM	C2	1.77	1.326	2.194
36BM	H3	2.497	1.12	0.834		36BM	H3	1.868	1.341	2.148
36BM	H4	2.497	1.248	0.714		36BM	H4	1.787	1.356	2.297
36BM	C3	2.451	1.052	0.634		36BM	C3	1.732	1.18	2.178
36BM	O1	2.736	1.215	0.814		36BM	O1	1.68	1.546	2.157
36BM	C4	2.877	1.209	0.806		36BM	C4	1.61	1.631	2.072
36BM	H5	2.912	1.253	0.713		36BM	H5	1.644	1.628	1.968
36BM	H6	2.922	1.262	0.889		36BM	H6	1.502	1.618	2.073
36BM	H7	2.912	1.105	0.812		36BM	H7	1.631	1.732	2.108
36BM	H8	2.472	0.947	0.659		36BM	H8	1.698	1.163	2.076
36BM	H9	2.487	1.066	0.533		36BM	H9	1.653	1.156	2.249
36BM	C5	2.3	1.076	0.639		36BM	C5	1.853	1.089	2.205
36BM	H10	2.278	1.177	0.604		36BM	H10	1.864	1.071	2.312
36BM	H11	2.248	1.006	0.575		36BM	H11	1.827	0.993	2.161
36BM	H12	2.261	1.064	0.739		36BM	H12	1.946	1.135	2.17
37BM	C1	2.756	2.617	1.568		37BM	C1	0.438	0.194	2.112
37BM	H1	2.799	2.638	1.47		37BM	H1	0.528	0.239	2.152
37BM	H2	2.831	2.56	1.622		37BM	H2	0.45	0.165	2.007
37BM	C2	2.626	2.537	1.554		37BM	C2	0.324	0.296	2.123
37BM	H3	2.565	2.554	1.642		37BM	H3	0.324	0.34	2.223
37BM	H4	2.569	2.577	1.47		37BM	H4	0.354	0.386	2.068
37BM	C3	2.647	2.385	1.537		37BM	C3	0.19	0.244	2.075
37BM	O1	2.725	2.738	1.635		37BM	O1	0.397	0.066	2.164
37BM	C4	2.838	2.821	1.653		37BM	C4	0.433	0.068	2.295
37BM	H5	2.887	2.844	1.557		37BM	H5	0.407	0.158	2.351
37BM	H6	2.808	2.916	1.698		37BM	H6	0.377	-0.006	2.354
37BM	H7	2.911	2.774	1.719		37BM	H7	0.537	0.038	2.308
37BM	H8	2.702	2.347	1.622		37BM	H8	0.161	0.167	2.146
37BM	H9	2.706	2.363	1.449		37BM	H9	0.194	0.194	1.978
37BM	C5	2.514	2.31	1.526		37BM	C5	0.08	0.353	2.092
37BM	H10	2.457	2.347	1.442		37BM	H10	-0.018	0.326	2.053
37BM	H11	2.531	2.203	1.511		37BM	H11	0.077	0.365	2.2
37BM	H12	2.453	2.321	1.616		37BM	H12	0.103	0.449	2.044
38BM	C1	0.724	1.36	1.161		38BM	C1	0.223	1.267	1.589
38BM	H1	0.766	1.316	1.251		38BM	H1	0.163	1.315	1.511
38BM	H2	0.727	1.469	1.171		38BM	H2	0.308	1.329	1.615
38BM	C2	0.581	1.311	1.141		38BM	C2	0.269	1.124	1.552
38BM	H3	0.53	1.374	1.069		38BM	H3	0.357	1.13	1.488
38BM	H4	0.584	1.211	1.097		38BM	H4	0.314	1.075	1.638
38BM	C3	0.502	1.306	1.273		38BM	C3	0.15	1.055	1.495
38BM	O1	0.798	1.316	1.049		38BM	O1	0.158	1.244	1.711
38BM	C4	0.937	1.335	1.063		38BM	C4	0.114	1.369	1.755
38BM	H5	0.974	1.279	1.148		38BM	H5	0.018	1.38	1.706
38BM	H6	0.987	1.298	0.973		38BM	H6	0.092	1.376	1.862
38BM	H7	0.961	1.441	1.075		38BM	H7	0.178	1.456	1.741
38BM	H8	0.473	1.407	1.301		38BM	H8	0.109	1.108	1.409
38BM	H9	0.565	1.271	1.354		38BM	H9	0.07	1.056	1.569
38BM	C5	0.378	1.216	1.263		38BM	C5	0.177	0.907	1.452
38BM	H10	0.406	1.113	1.238		38BM	H10	0.216	0.894	1.351
38BM	H11	0.325	1.215	1.358		38BM	H11	0.23	0.852	1.53
38BM	H12	0.31	1.252	1.186		38BM	H12	0.074	0.872	1.445
39BM	C1	1.597	2.097	0.478		39BM	C1	2.851	1.358	1.126
39BM	H1	1.665	2.1	0.563		39BM	H1	2.764	1.296	1.147
39BM	H2	1.61	2.19	0.422		39BM	H2	2.846	1.409	1.03
39BM	C2	1.453	2.087	0.53		39BM	C2	2.982	1.286	1.156
39BM	H3	1.382	2.089	0.447		39BM	H3	3.056	1.364	1.173
39BM	H4	1.442	1.991	0.579		39BM	H4	2.984	1.235	1.251
39BM	C3	1.414	2.191	0.635		39BM	C3	3.016	1.188	1.052
39BM	O1	1.628	1.984	0.396		39BM	O1	2.846	1.456	1.224
39BM	C4	1.766	1.977	0.365		39BM	C4	2.714	1.507	1.263
39BM	H5	1.822	1.935	0.449		39BM	H5	2.658	1.537	1.174
39BM	H6	1.783	1.912	0.279		39BM	H6	2.66	1.425	1.309
39BM	H7	1.808	2.074	0.341		39BM	H7	2.727	1.583	1.34
39BM	H8	1.397	2.288	0.588		39BM	H8	3.026	1.227	0.951
39BM	H9	1.494	2.205	0.707		39BM	H9	2.932	1.118	1.055
39BM	C5	1.287	2.147	0.709		39BM	C5	3.139	1.097	1.082
39BM	H10	1.299	2.05	0.757		39BM	H10	3.218	1.171	1.092
39BM	H11	1.26	2.218	0.787		39BM	H11	3.125	1.027	1.164
39BM	H12	1.202	2.14	0.641		39BM	H12	3.165	1.041	0.993
40BM	C1	2.517	0.198	2.932		40BM	C1	2.031	2.331	1.31
40BM	H1	2.568	0.109	2.895		40BM	H1	2.088	2.41	1.26
40BM	H2	2.486	0.255	2.845		40BM	H2	2.106	2.283	1.373
40BM	C2	2.617	0.278	3.018		40BM	C2	1.98	2.231	1.207
40BM	H3	2.572	0.375	3.044		40BM	H3	2.072	2.199	1.158
40BM	H4	2.635	0.227	3.112		40BM	H4	1.937	2.145	1.259
40BM	C3	2.75	0.303	2.945		40BM	C3	1.887	2.304	1.104
40BM	O1	2.403	0.155	3.006		40BM	O1	1.927	2.377	1.398
40BM	C4	2.321	0.261	3.053		40BM	C4	1.972	2.474	1.494
40BM	H5	2.29	0.326	2.971		40BM	H5	2.03	2.422	1.571
40BM	H6	2.231	0.22	3.099		40BM	H6	2.019	2.562	1.45
40BM	H7	2.371	0.321	3.128		40BM	H7	1.886	2.498	1.555
40BM	H8	2.731	0.331	2.841		40BM	H8	1.904	2.411	1.089
40BM	H9	2.807	0.21	2.942		40BM	H9	1.794	2.312	1.16
40BM	C5	2.833	0.413	3.012		40BM	C5	1.879	2.232	0.969
40BM	H10	2.846	0.395	3.118		40BM	H10	1.796	2.263	0.905
40BM	H11	2.931	0.422	2.966		40BM	H11	1.973	2.228	0.914
40BM	H12	2.784	0.51	3.001		40BM	H12	1.853	2.127	0.977
41BM	C1	1.326	2.241	2.059		41BM	C1	1.877	1.246	1.798
41BM	H1	1.257	2.195	1.987		41BM	H1	1.802	1.278	1.871
41BM	H2	1.427	2.218	2.026		41BM	H2	1.823	1.192	1.72
41BM	C2	1.303	2.184	2.199		41BM	C2	1.979	1.154	1.87
41BM	H3	1.362	2.241	2.27		41BM	H3	2.035	1.211	1.944
41BM	H4	1.199	2.2	2.227		41BM	H4	1.932	1.075	1.927
41BM	C3	1.338	2.035	2.207		41BM	C3	2.069	1.093	1.764
41BM	O1	1.307	2.381	2.062		41BM	O1	1.94	1.367	1.761
41BM	C4	1.331	2.44	1.935		41BM	C4	1.854	1.47	1.698
41BM	H5	1.264	2.4	1.859		41BM	H5	1.747	1.451	1.712
41BM	H6	1.315	2.548	1.94		41BM	H6	1.862	1.571	1.741
41BM	H7	1.434	2.423	1.903		41BM	H7	1.887	1.468	1.595
41BM	H8	1.446	2.022	2.192		41BM	H8	2.094	1.18	1.704
41BM	H9	1.291	1.98	2.125		41BM	H9	2.012	1.019	1.707
41BM	C5	1.297	1.969	2.339		41BM	C5	2.205	1.03	1.809
41BM	H10	1.189	1.973	2.353		41BM	H10	2.264	1.026	1.718
41BM	H11	1.326	1.864	2.34		41BM	H11	2.25	1.077	1.896
41BM	H12	1.345	2.017	2.425		41BM	H12	2.195	0.928	1.846
42BM	C1	2.988	1.258	2.208		42BM	C1	2.805	1.726	2.925
42BM	H1	3.058	1.325	2.259		42BM	H1	2.708	1.743	2.973
42BM	H2	3.047	1.179	2.161		42BM	H2	2.89	1.725	2.993
42BM	C2	2.907	1.334	2.103		42BM	C2	2.826	1.854	2.832
42BM	H3	2.846	1.263	2.047		42BM	H3	2.819	1.943	2.894
42BM	H4	2.837	1.4	2.154		42BM	H4	2.925	1.857	2.787
42BM	C3	2.994	1.416	2.007		42BM	C3	2.721	1.859	2.716
42BM	O1	2.897	1.204	2.303		42BM	O1	2.801	1.606	2.845
42BM	C4	2.961	1.128	2.404		42BM	C4	2.779	1.494	2.932
42BM	H5	3.032	1.188	2.462		42BM	H5	2.863	1.464	2.995
42BM	H6	2.887	1.088	2.473		42BM	H6	2.685	1.508	2.985
42BM	H7	3.015	1.044	2.362		42BM	H7	2.764	1.401	2.877
42BM	H8	3.058	1.349	1.95		42BM	H8	2.634	1.898	2.768
42BM	H9	3.062	1.48	2.063		42BM	H9	2.693	1.761	2.678
42BM	C5	2.912	1.503	1.912		42BM	C5	2.762	1.944	2.593
42BM	H10	2.853	1.577	1.967		42BM	H10	2.77	2.048	2.622
42BM	H11	2.977	1.558	1.844		42BM	H11	2.857	1.908	2.554
42BM	H12	2.844	1.444	1.852		42BM	H12	2.687	1.935	2.515
43BM	C1	0.156	0.551	2.294		43BM	C1	2.953	0.739	2.66
43BM	H1	0.055	0.515	2.313		43BM	H1	3.037	0.759	2.726
43BM	H2	0.174	0.546	2.187		43BM	H2	2.918	0.637	2.676
43BM	C2	0.259	0.467	2.369		43BM	C2	3.006	0.751	2.515
43BM	H3	0.358	0.511	2.353		43BM	H3	2.915	0.734	2.459
43BM	H4	0.24	0.474	2.477		43BM	H4	3.038	0.855	2.518
43BM	C3	0.261	0.321	2.324		43BM	C3	3.116	0.645	2.486
43BM	O1	0.17	0.684	2.34		43BM	O1	2.851	0.836	2.674
43BM	C4	0.088	0.776	2.27		43BM	C4	2.765	0.812	2.785
43BM	H5	-0.017	0.752	2.281		43BM	H5	2.683	0.883	2.779
43BM	H6	0.106	0.876	2.31		43BM	H6	2.725	0.711	2.789
43BM	H7	0.113	0.778	2.164		43BM	H7	2.822	0.818	2.878
43BM	H8	0.272	0.316	2.216		43BM	H8	3.087	0.549	2.528
43BM	H9	0.165	0.274	2.347		43BM	H9	3.211	0.675	2.531
43BM	C5	0.374	0.242	2.389		43BM	C5	3.151	0.641	2.337
43BM	H10	0.363	0.235	2.497		43BM	H10	3.207	0.728	2.302
43BM	H11	0.379	0.141	2.349		43BM	H11	3.217	0.556	2.319
43BM	H12	0.471	0.288	2.368		43BM	H12	3.07	0.629	2.266
44BM	C1	1.797	1.811	1.348		44BM	C1	0.912	1.632	1.222
44BM	H1	1.784	1.778	1.245		44BM	H1	0.978	1.692	1.161
44BM	H2	1.7	1.839	1.387		44BM	H2	0.886	1.677	1.318
44BM	C2	1.893	1.93	1.352		44BM	C2	0.982	1.493	1.254
44BM	H3	1.906	1.961	1.455		44BM	H3	0.939	1.441	1.34
44BM	H4	1.991	1.897	1.317		44BM	H4	0.981	1.434	1.163
44BM	C3	1.84	2.047	1.267		44BM	C3	1.126	1.517	1.29
44BM	O1	1.849	1.704	1.425		44BM	O1	0.791	1.606	1.148
44BM	C4	1.757	1.596	1.431		44BM	C4	0.819	1.599	1.009
44BM	H5	1.734	1.558	1.331		44BM	H5	0.866	1.687	0.967
44BM	H6	1.801	1.515	1.487		44BM	H6	0.881	1.511	0.994
44BM	H7	1.665	1.625	1.48		44BM	H7	0.725	1.582	0.957
44BM	H8	1.756	2.094	1.317		44BM	H8	1.126	1.576	1.382
44BM	H9	1.803	2.01	1.172		44BM	H9	1.184	1.574	1.218
44BM	C5	1.947	2.153	1.239		44BM	C5	1.195	1.384	1.322
44BM	H10	2.035	2.109	1.192		44BM	H10	1.157	1.355	1.419
44BM	H11	1.908	2.228	1.17		44BM	H11	1.176	1.323	1.233
44BM	H12	1.978	2.203	1.33		44BM	H12	1.303	1.397	1.333
45BM	C1	1.511	1.056	2.066		45BM	C1	2.517	1.497	2.557
45BM	H1	1.522	1.043	1.958		45BM	H1	2.595	1.506	2.633
45BM	H2	1.525	0.959	2.114		45BM	H2	2.441	1.438	2.609
45BM	C2	1.372	1.111	2.097		45BM	C2	2.579	1.41	2.45
45BM	H3	1.365	1.133	2.204		45BM	H3	2.514	1.372	2.372
45BM	H4	1.358	1.205	2.045		45BM	H4	2.655	1.473	2.404
45BM	C3	1.258	1.015	2.059		45BM	C3	2.652	1.296	2.527
45BM	O1	1.607	1.147	2.116		45BM	O1	2.479	1.621	2.506
45BM	C4	1.74	1.114	2.083		45BM	C4	2.4	1.698	2.598
45BM	H5	1.756	1.121	1.975		45BM	H5	2.395	1.797	2.554
45BM	H6	1.807	1.183	2.132		45BM	H6	2.305	1.646	2.61
45BM	H7	1.765	1.013	2.117		45BM	H7	2.453	1.699	2.694
45BM	H8	1.27	0.921	2.113		45BM	H8	2.581	1.249	2.595
45BM	H9	1.265	0.991	1.953		45BM	H9	2.743	1.323	2.58
45BM	C5	1.12	1.075	2.089		45BM	C5	2.706	1.181	2.441
45BM	H10	1.104	1.17	2.037		45BM	H10	2.743	1.1	2.504
45BM	H11	1.04	1.008	2.056		45BM	H11	2.622	1.127	2.398
45BM	H12	1.106	1.093	2.195		45BM	H12	2.777	1.207	2.363
46BM	C1	1.456	0.943	0.959		46BM	C1	2.365	2.175	2.18
46BM	H1	1.522	0.864	0.996		46BM	H1	2.273	2.177	2.122
46BM	H2	1.448	1.016	1.039		46BM	H2	2.42	2.08	2.171
46BM	C2	1.319	0.889	0.922		46BM	C2	2.329	2.169	2.327
46BM	H3	1.255	0.973	0.897		46BM	H3	2.278	2.259	2.363
46BM	H4	1.327	0.829	0.831		46BM	H4	2.251	2.095	2.343
46BM	C3	1.254	0.806	1.033		46BM	C3	2.448	2.134	2.415
46BM	O1	1.508	0.999	0.841		46BM	O1	2.432	2.297	2.152
46BM	C4	1.599	1.106	0.861		46BM	C4	2.521	2.274	2.041
46BM	H5	1.677	1.081	0.932		46BM	H5	2.476	2.268	1.942
46BM	H6	1.645	1.127	0.765		46BM	H6	2.587	2.361	2.051
46BM	H7	1.546	1.195	0.894		46BM	H7	2.581	2.185	2.057
46BM	H8	1.239	0.868	1.121		46BM	H8	2.53	2.197	2.381
46BM	H9	1.321	0.726	1.063		46BM	H9	2.476	2.031	2.391
46BM	C5	1.12	0.747	0.986		46BM	C5	2.424	2.159	2.558
46BM	H10	1.079	0.674	1.055		46BM	H10	2.325	2.13	2.594
46BM	H11	1.045	0.825	0.973		46BM	H11	2.496	2.109	2.623
46BM	H12	1.13	0.696	0.891		46BM	H12	2.429	2.265	2.583
47BM	C1	1.767	0.451	1.308		47BM	C1	2.505	1.021	2.935
47BM	H1	1.792	0.503	1.4		47BM	H1	2.59	0.965	2.975
47BM	H2	1.715	0.359	1.335		47BM	H2	2.446	1.047	3.023
47BM	C2	1.894	0.419	1.228		47BM	C2	2.417	0.936	2.84
47BM	H3	1.867	0.373	1.133		47BM	H3	2.34	1.008	2.812
47BM	H4	1.944	0.513	1.203		47BM	H4	2.48	0.909	2.756
47BM	C3	1.992	0.33	1.305		47BM	C3	2.359	0.804	2.899
47BM	O1	1.684	0.532	1.226		47BM	O1	2.555	1.137	2.871
47BM	C4	1.56	0.564	1.286		47BM	C4	2.489	1.26	2.888
47BM	H5	1.574	0.617	1.38		47BM	H5	2.546	1.335	2.835
47BM	H6	1.503	0.628	1.219		47BM	H6	2.385	1.26	2.854
47BM	H7	1.501	0.474	1.305		47BM	H7	2.493	1.291	2.993
47BM	H8	1.943	0.236	1.333		47BM	H8	2.306	0.819	2.993
47BM	H9	2.02	0.379	1.398		47BM	H9	2.441	0.736	2.921
47BM	C5	2.119	0.299	1.224		47BM	C5	2.275	0.733	2.796
47BM	H10	2.17	0.391	1.194		47BM	H10	2.207	0.814	2.768
47BM	H11	2.189	0.241	1.284		47BM	H11	2.325	0.686	2.711
47BM	H12	2.097	0.242	1.134		47BM	H12	2.225	0.649	2.844
48BM	C1	2.197	2.079	2.251		48BM	C1	0.611	1.246	1.814
48BM	H1	2.217	1.983	2.204		48BM	H1	0.628	1.287	1.714
48BM	H2	2.272	2.093	2.329		48BM	H2	0.566	1.147	1.811
48BM	C2	2.056	2.081	2.309		48BM	C2	0.51	1.346	1.879
48BM	H3	2.037	2.178	2.355		48BM	H3	0.542	1.45	1.872
48BM	H4	1.983	2.072	2.228		48BM	H4	0.415	1.329	1.828
48BM	C3	2.033	1.968	2.41		48BM	C3	0.482	1.31	2.025
48BM	O1	2.206	2.184	2.157		48BM	O1	0.727	1.237	1.883
48BM	C4	2.322	2.176	2.076		48BM	C4	0.829	1.333	1.861
48BM	H5	2.326	2.082	2.022		48BM	H5	0.854	1.338	1.755
48BM	H6	2.32	2.255	2.001		48BM	H6	0.804	1.434	1.894
48BM	H7	2.413	2.187	2.134		48BM	H7	0.919	1.305	1.915
48BM	H8	2.117	1.963	2.48		48BM	H8	0.452	1.394	2.088
48BM	H9	2.033	1.873	2.356		48BM	H9	0.572	1.269	2.069
48BM	C5	1.903	1.984	2.489		48BM	C5	0.38	1.191	2.035
48BM	H10	1.817	1.996	2.422		48BM	H10	0.423	1.099	1.996
48BM	H11	1.884	1.897	2.552		48BM	H11	0.367	1.16	2.139
48BM	H12	1.905	2.072	2.553		48BM	H12	0.282	1.212	1.993
49BM	C1	1.953	2.894	2.036		49BM	C1	2.724	0.674	1.208
49BM	H1	1.966	2.822	1.955		49BM	H1	2.685	0.759	1.264
49BM	H2	2.032	2.872	2.108		49BM	H2	2.748	0.585	1.266
49BM	C2	1.814	2.872	2.101		49BM	C2	2.86	0.707	1.147
49BM	H3	1.81	2.922	2.197		49BM	H3	2.883	0.628	1.075
49BM	H4	1.736	2.918	2.04		49BM	H4	2.869	0.797	1.088
49BM	C3	1.781	2.723	2.121		49BM	C3	2.981	0.704	1.237
49BM	O1	1.973	3.024	1.979		49BM	O1	2.631	0.634	1.108
49BM	C4	1.935	3.132	2.064		49BM	C4	2.516	0.578	1.158
49BM	H5	1.826	3.141	2.069		49BM	H5	2.547	0.482	1.197
49BM	H6	1.973	3.119	2.165		49BM	H6	2.467	0.642	1.232
49BM	H7	1.973	3.227	2.025		49BM	H7	2.453	0.569	1.069
49BM	H8	1.857	2.676	2.182		49BM	H8	2.99	0.624	1.312
49BM	H9	1.784	2.671	2.025		49BM	H9	2.978	0.797	1.294
49BM	C5	1.643	2.7	2.183		49BM	C5	3.114	0.693	1.158
49BM	H10	1.564	2.744	2.122		49BM	H10	3.207	0.687	1.215
49BM	H11	1.621	2.594	2.193		49BM	H11	3.121	0.595	1.112
49BM	H12	1.636	2.745	2.283		49BM	H12	3.124	0.768	1.079
50BM	C1	1.626	1.808	1.995		50BM	C1	0.911	1.164	0.499
50BM	H1	1.674	1.898	1.956		50BM	H1	0.998	1.099	0.485
50BM	H2	1.694	1.725	1.98		50BM	H2	0.952	1.263	0.477
50BM	C2	1.495	1.782	1.919		50BM	C2	0.869	1.16	0.649
50BM	H3	1.449	1.691	1.957		50BM	H3	0.786	1.227	0.668
50BM	H4	1.425	1.863	1.939		50BM	H4	0.829	1.061	0.669
50BM	C3	1.518	1.768	1.768		50BM	C3	0.987	1.181	0.738
50BM	O1	1.595	1.823	2.132		50BM	O1	0.803	1.138	0.414
50BM	C4	1.708	1.839	2.215		50BM	C4	0.767	1.004	0.405
50BM	H5	1.758	1.935	2.197		50BM	H5	0.855	0.946	0.377
50BM	H6	1.676	1.837	2.319		50BM	H6	0.727	0.951	0.492
50BM	H7	1.781	1.759	2.2		50BM	H7	0.69	0.992	0.329
50BM	H8	1.582	1.682	1.748		50BM	H8	1.011	1.286	0.721
50BM	H9	1.57	1.856	1.729		50BM	H9	1.073	1.129	0.696
50BM	C5	1.386	1.752	1.692		50BM	C5	0.964	1.155	0.892
50BM	H10	1.321	1.838	1.706		50BM	H10	0.944	1.05	0.917
50BM	H11	1.405	1.742	1.585		50BM	H11	1.06	1.183	0.937
50BM	H12	1.332	1.663	1.726		50BM	H12	0.887	1.22	0.934
51BM	C1	1.357	2.546	0.938		51BM	C1	1.302	2.526	1.758
51BM	H1	1.389	2.49	0.85		51BM	H1	1.287	2.543	1.864
51BM	H2	1.248	2.556	0.928		51BM	H2	1.275	2.421	1.748
51BM	C2	1.426	2.682	0.935		51BM	C2	1.441	2.575	1.711
51BM	H3	1.512	2.681	1.002		51BM	H3	1.448	2.571	1.602
51BM	H4	1.467	2.698	0.835		51BM	H4	1.461	2.678	1.74
51BM	C3	1.335	2.801	0.969		51BM	C3	1.556	2.494	1.769
51BM	O1	1.39	2.478	1.059		51BM	O1	1.206	2.597	1.677
51BM	C4	1.418	2.34	1.036		51BM	C4	1.171	2.527	1.562
51BM	H5	1.5	2.327	0.965		51BM	H5	1.257	2.497	1.502
51BM	H6	1.448	2.291	1.128		51BM	H6	1.109	2.438	1.576
51BM	H7	1.331	2.288	0.997		51BM	H7	1.107	2.59	1.501
51BM	H8	1.288	2.786	1.066		51BM	H8	1.636	2.473	1.698
51BM	H9	1.252	2.805	0.898		51BM	H9	1.509	2.397	1.784
51BM	C5	1.41	2.934	0.966		51BM	C5	1.622	2.55	1.898
51BM	H10	1.459	2.95	0.87		51BM	H10	1.685	2.482	1.955
51BM	H11	1.342	3.018	0.982		51BM	H11	1.676	2.641	1.872
51BM	H12	1.486	2.938	1.044		51BM	H12	1.538	2.589	1.957
52BM	C1	1.094	2.83	0.399		52BM	C1	1.146	0.455	2.132
52BM	H1	1.048	2.736	0.429		52BM	H1	1.255	0.451	2.143
52BM	H2	1.02	2.908	0.413		52BM	H2	1.131	0.506	2.037
52BM	C2	1.137	2.82	0.252		52BM	C2	1.094	0.537	2.251
52BM	H3	1.181	2.914	0.22		52BM	H3	1.123	0.641	2.237
52BM	H4	1.217	2.746	0.245		52BM	H4	0.986	0.547	2.268
52BM	C3	1.022	2.778	0.161		52BM	C3	1.145	0.485	2.388
52BM	O1	1.21	2.858	0.476		52BM	O1	1.085	0.33	2.126
52BM	C4	1.191	2.828	0.612		52BM	C4	1.138	0.237	2.025
52BM	H5	1.173	2.722	0.625		52BM	H5	1.125	0.274	1.924
52BM	H6	1.28	2.851	0.67		52BM	H6	1.24	0.22	2.057
52BM	H7	1.107	2.884	0.655		52BM	H7	1.091	0.138	2.024
52BM	H8	0.941	2.85	0.165		52BM	H8	1.253	0.47	2.381
52BM	H9	0.98	2.684	0.197		52BM	H9	1.105	0.385	2.402
52BM	C5	1.068	2.76	0.016		52BM	C5	1.111	0.582	2.5
52BM	H10	1.141	2.679	0.008		52BM	H10	1.13	0.54	2.599
52BM	H11	0.984	2.735	-0.048		52BM	H11	1.157	0.679	2.481
52BM	H12	1.114	2.85	-0.022		52BM	H12	1.003	0.594	2.505
53BM	C1	2.161	0.869	1.665		53BM	C1	2.014	1.596	0.998
53BM	H1	2.205	0.852	1.764		53BM	H1	1.929	1.61	0.932
53BM	H2	2.127	0.771	1.63		53BM	H2	2.105	1.617	0.941
53BM	C2	2.266	0.924	1.57		53BM	C2	2.018	1.456	1.062
53BM	H3	2.22	0.949	1.475		53BM	H3	2.113	1.462	1.115
53BM	H4	2.312	1.015	1.611		53BM	H4	1.929	1.464	1.125
53BM	C3	2.375	0.822	1.538		53BM	C3	2.038	1.341	0.966
53BM	O1	2.052	0.96	1.672		53BM	O1	2.014	1.69	1.1
53BM	C4	1.96	0.909	1.77		53BM	C4	1.981	1.82	1.056
53BM	H5	2.003	0.909	1.87		53BM	H5	1.882	1.823	1.011
53BM	H6	1.867	0.967	1.775		53BM	H6	1.984	1.88	1.147
53BM	H7	1.931	0.806	1.749		53BM	H7	2.055	1.857	0.985
53BM	H8	2.329	0.727	1.508		53BM	H8	2.11	1.369	0.889
53BM	H9	2.435	0.8	1.626		53BM	H9	1.942	1.334	0.916
53BM	C5	2.462	0.87	1.422		53BM	C5	2.064	1.214	1.038
53BM	H10	2.511	0.965	1.445		53BM	H10	1.986	1.175	1.104
53BM	H11	2.539	0.798	1.397		53BM	H11	2.077	1.133	0.966
53BM	H12	2.403	0.886	1.332		53BM	H12	2.161	1.22	1.086
54BM	C1	1.523	0.461	0.678		54BM	C1	2.276	1.493	1.353
54BM	H1	1.618	0.434	0.723		54BM	H1	2.325	1.495	1.451
54BM	H2	1.526	0.569	0.665		54BM	H2	2.328	1.423	1.289
54BM	C2	1.408	0.424	0.773		54BM	C2	2.255	1.636	1.298
54BM	H3	1.311	0.443	0.726		54BM	H3	2.237	1.633	1.191
54BM	H4	1.414	0.318	0.796		54BM	H4	2.169	1.666	1.358
54BM	C3	1.411	0.5	0.905		54BM	C3	2.37	1.725	1.324
54BM	O1	1.504	0.393	0.554		54BM	O1	2.156	1.427	1.361
54BM	C4	1.601	0.434	0.458		54BM	C4	2.148	1.312	1.447
54BM	H5	1.703	0.424	0.495		54BM	H5	2.057	1.252	1.445
54BM	H6	1.596	0.376	0.366		54BM	H6	2.235	1.248	1.434
54BM	H7	1.585	0.538	0.429		54BM	H7	2.158	1.346	1.551
54BM	H8	1.399	0.606	0.886		54BM	H8	2.458	1.67	1.292
54BM	H9	1.507	0.488	0.955		54BM	H9	2.386	1.739	1.431
54BM	C5	1.299	0.45	0.998		54BM	C5	2.35	1.858	1.255
54BM	H10	1.308	0.343	1.017		54BM	H10	2.432	1.925	1.279
54BM	H11	1.304	0.499	1.095		54BM	H11	2.345	1.841	1.147
54BM	H12	1.2	0.468	0.957		54BM	H12	2.26	1.911	1.287
55BM	C1	1.848	1.876	0.917		55BM	C1	3.005	2.119	1.418
55BM	H1	1.765	1.842	0.979		55BM	H1	3.029	2.105	1.523
55BM	H2	1.84	1.826	0.82		55BM	H2	3.094	2.091	1.362
55BM	C2	1.98	1.84	0.986		55BM	C2	2.963	2.267	1.394
55BM	H3	2.064	1.873	0.924		55BM	H3	2.905	2.294	1.307
55BM	H4	1.989	1.897	1.078		55BM	H4	2.886	2.291	1.467
55BM	C3	1.992	1.69	1.017		55BM	C3	3.086	2.359	1.425
55BM	O1	1.842	2.016	0.901		55BM	O1	2.894	2.038	1.376
55BM	C4	1.713	2.061	0.864		55BM	C4	2.92	1.9	1.413
55BM	H5	1.64	2.042	0.943		55BM	H5	2.939	1.879	1.518
55BM	H6	1.715	2.169	0.847		55BM	H6	2.838	1.834	1.384
55BM	H7	1.679	2.012	0.773		55BM	H7	2.991	1.849	1.348
55BM	H8	1.996	1.634	0.924		55BM	H8	3.055	2.458	1.391
55BM	H9	1.904	1.658	1.071		55BM	H9	3.172	2.328	1.366
55BM	C5	2.115	1.657	1.102		55BM	C5	3.12	2.363	1.578
55BM	H10	2.114	1.709	1.198		55BM	H10	3.136	2.267	1.626
55BM	H11	2.12	1.55	1.124		55BM	H11	3.198	2.435	1.603
55BM	H12	2.208	1.684	1.052		55BM	H12	3.028	2.395	1.629
56BM	C1	2.574	1.982	0.544		56BM	C1	2.878	2.643	1.075
56BM	H1	2.51	1.951	0.462		56BM	H1	2.983	2.659	1.048
56BM	H2	2.656	1.91	0.552		56BM	H2	2.846	2.54	1.059
56BM	C2	2.495	1.986	0.674		56BM	C2	2.796	2.738	0.99
56BM	H3	2.561	2.014	0.756		56BM	H3	2.689	2.717	1
56BM	H4	2.42	2.065	0.669		56BM	H4	2.808	2.835	1.037
56BM	C3	2.428	1.851	0.705		56BM	C3	2.828	2.73	0.834
56BM	O1	2.625	2.112	0.519		56BM	O1	2.855	2.681	1.215
56BM	C4	2.701	2.118	0.4		56BM	C4	2.745	2.601	1.274
56BM	H5	2.641	2.088	0.313		56BM	H5	2.653	2.625	1.221
56BM	H6	2.735	2.22	0.383		56BM	H6	2.763	2.495	1.256
56BM	H7	2.788	2.053	0.406		56BM	H7	2.727	2.627	1.378
56BM	H8	2.504	1.776	0.726		56BM	H8	2.76	2.659	0.788
56BM	H9	2.374	1.817	0.617		56BM	H9	2.93	2.694	0.827
56BM	C5	2.329	1.859	0.822		56BM	C5	2.804	2.866	0.764
56BM	H10	2.247	1.926	0.799		56BM	H10	2.828	2.956	0.821
56BM	H11	2.287	1.761	0.843		56BM	H11	2.879	2.863	0.685
56BM	H12	2.377	1.896	0.913		56BM	H12	2.702	2.875	0.728
57BM	C1	1.256	2.899	1.722		57BM	C1	0.662	1.004	1.185
57BM	H1	1.245	3.005	1.745		57BM	H1	0.749	1.006	1.119
57BM	H2	1.362	2.877	1.71		57BM	H2	0.619	1.104	1.177
57BM	C2	1.182	2.865	1.592		57BM	C2	0.707	0.961	1.325
57BM	H3	1.185	2.757	1.578		57BM	H3	0.621	0.939	1.389
57BM	H4	1.077	2.892	1.601		57BM	H4	0.757	0.864	1.322
57BM	C3	1.242	2.936	1.469		57BM	C3	0.795	1.063	1.402
57BM	O1	1.201	2.82	1.825		57BM	O1	0.577	0.902	1.13
57BM	C4	1.267	2.835	1.949		57BM	C4	0.447	0.941	1.14
57BM	H5	1.259	2.937	1.987		57BM	H5	0.413	0.95	1.243
57BM	H6	1.222	2.769	2.022		57BM	H6	0.421	1.035	1.09
57BM	H7	1.373	2.809	1.941		57BM	H7	0.379	0.867	1.1
57BM	H8	1.35	2.926	1.47		57BM	H8	0.733	1.129	1.463
57BM	H9	1.222	3.043	1.474		57BM	H9	0.856	1.126	1.338
57BM	C5	1.188	2.879	1.337		57BM	C5	0.892	0.998	1.496
57BM	H10	1.086	2.911	1.318		57BM	H10	0.985	1.053	1.486
57BM	H11	1.249	2.911	1.254		57BM	H11	0.858	1.002	1.6
57BM	H12	1.19	2.77	1.337		57BM	H12	0.919	0.895	1.472
58BM	C1	2.747	0.185	1.517		58BM	C1	2.805	2.639	2.206
58BM	H1	2.794	0.177	1.418		58BM	H1	2.732	2.697	2.151
58BM	H2	2.814	0.133	1.587		58BM	H2	2.9	2.656	2.156
58BM	C2	2.61	0.116	1.519		58BM	C2	2.784	2.497	2.223
58BM	H3	2.576	0.104	1.622		58BM	H3	2.69	2.476	2.274
58BM	H4	2.534	0.177	1.47		58BM	H4	2.767	2.456	2.123
58BM	C3	2.613	-0.021	1.45		58BM	C3	2.889	2.407	2.285
58BM	O1	2.731	0.321	1.553		58BM	O1	2.813	2.684	2.335
58BM	C4	2.855	0.389	1.559		58BM	C4	2.79	2.824	2.348
58BM	H5	2.9	0.398	1.46		58BM	H5	2.689	2.846	2.314
58BM	H6	2.841	0.49	1.597		58BM	H6	2.805	2.844	2.455
58BM	H7	2.927	0.338	1.624		58BM	H7	2.864	2.892	2.304
58BM	H8	2.658	-0.094	1.517		58BM	H8	2.921	2.449	2.381
58BM	H9	2.678	-0.018	1.362		58BM	H9	2.981	2.407	2.227
58BM	C5	2.475	-0.069	1.408		58BM	C5	2.842	2.265	2.312
58BM	H10	2.428	0.001	1.339		58BM	H10	2.831	2.215	2.215
58BM	H11	2.481	-0.167	1.359		58BM	H11	2.916	2.208	2.367
58BM	H12	2.41	-0.081	1.495		58BM	H12	2.748	2.256	2.367
59BM	C1	1.025	2.305	2.753		59BM	C1	0.017	2.113	0.108
59BM	H1	0.985	2.304	2.854		59BM	H1	0.052	2.171	0.193
59BM	H2	1.134	2.303	2.764		59BM	H2	-0.033	2.184	0.042
59BM	C2	0.981	2.435	2.682		59BM	C2	-0.078	2.002	0.165
59BM	H3	1.027	2.441	2.583		59BM	H3	-0.099	1.942	0.077
59BM	H4	0.873	2.433	2.666		59BM	H4	-0.014	1.941	0.228
59BM	C3	1.02	2.56	2.761		59BM	C3	-0.212	2.038	0.236
59BM	O1	0.98	2.188	2.685		59BM	O1	0.144	2.073	0.053
59BM	C4	1.029	2.179	2.551		59BM	C4	0.128	2.007	-0.074
59BM	H5	0.974	2.245	2.484		59BM	H5	0.099	1.903	-0.058
59BM	H6	1.135	2.202	2.544		59BM	H6	0.052	2.058	-0.133
59BM	H7	1.017	2.079	2.51		59BM	H7	0.223	1.993	-0.126
59BM	H8	1.127	2.557	2.784		59BM	H8	-0.261	2.123	0.189
59BM	H9	0.969	2.558	2.857		59BM	H9	-0.205	2.074	0.338
59BM	C5	0.988	2.69	2.686		59BM	C5	-0.312	1.919	0.233
59BM	H10	0.882	2.696	2.66		59BM	H10	-0.319	1.882	0.131
59BM	H11	1.012	2.776	2.747		59BM	H11	-0.278	1.836	0.294
59BM	H12	1.046	2.697	2.593		59BM	H12	-0.413	1.948	0.264
60BM	C1	0.172	1.256	2.79		60BM	C1	1.804	0.096	2.505
60BM	H1	0.242	1.242	2.872		60BM	H1	1.747	0.027	2.442
60BM	H2	0.229	1.251	2.697		60BM	H2	1.846	0.166	2.433
60BM	C2	0.101	1.39	2.804		60BM	C2	1.923	0.03	2.572
60BM	H3	0.026	1.394	2.725		60BM	H3	1.976	0.095	2.64
60BM	H4	0.048	1.388	2.9		60BM	H4	1.883	-0.042	2.644
60BM	C3	0.199	1.508	2.799		60BM	C3	2.019	-0.025	2.468
60BM	O1	0.074	1.153	2.793		60BM	O1	1.711	0.15	2.603
60BM	C4	0.136	1.025	2.785		60BM	C4	1.605	0.224	2.542
60BM	H5	0.21	1.011	2.864		60BM	H5	1.641	0.324	2.518
60BM	H6	0.061	0.948	2.796		60BM	H6	1.563	0.177	2.453
60BM	H7	0.186	1.011	2.689		60BM	H7	1.527	0.245	2.615
60BM	H8	0.236	1.527	2.698		60BM	H8	2.045	0.056	2.399
60BM	H9	0.288	1.474	2.852		60BM	H9	1.96	-0.096	2.41
60BM	C5	0.161	1.636	2.876		60BM	C5	2.146	-0.085	2.528
60BM	H10	0.129	1.609	2.976		60BM	H10	2.216	-0.133	2.46
60BM	H11	0.249	1.699	2.889		60BM	H11	2.21	-0.01	2.575
60BM	H12	0.083	1.7	2.837		60BM	H12	2.126	-0.159	2.605
61BM	C1	2.641	1.558	0.219		61BM	C1	0.969	0.708	0.775
61BM	H1	2.653	1.453	0.194		61BM	H1	1.033	0.7	0.863
61BM	H2	2.729	1.611	0.181		61BM	H2	0.947	0.606	0.746
61BM	C2	2.631	1.574	0.371		61BM	C2	1.028	0.792	0.664
61BM	H3	2.617	1.679	0.396		61BM	H3	0.943	0.813	0.6
61BM	H4	2.542	1.522	0.406		61BM	H4	1.045	0.894	0.698
61BM	C3	2.754	1.518	0.444		61BM	C3	1.14	0.732	0.579
61BM	O1	2.524	1.611	0.159		61BM	O1	0.842	0.767	0.805
61BM	C4	2.515	1.584	0.021		61BM	C4	0.773	0.693	0.914
61BM	H5	2.518	1.476	0.002		61BM	H5	0.77	0.585	0.895
61BM	H6	2.421	1.622	-0.019		61BM	H6	0.812	0.719	1.013
61BM	H7	2.597	1.631	-0.033		61BM	H7	0.668	0.72	0.91
61BM	H8	2.844	1.568	0.408		61BM	H8	1.177	0.803	0.505
61BM	H9	2.766	1.413	0.419		61BM	H9	1.099	0.653	0.515
61BM	C5	2.745	1.533	0.596		61BM	C5	1.26	0.695	0.653
61BM	H10	2.659	1.479	0.637		61BM	H10	1.338	0.662	0.584
61BM	H11	2.834	1.493	0.645		61BM	H11	1.303	0.78	0.707
61BM	H12	2.736	1.638	0.626		61BM	H12	1.246	0.62	0.73
62BM	C1	2.237	2.367	1.274		62BM	C1	0.066	0.258	0.497
62BM	H1	2.34	2.401	1.262		62BM	H1	-0.031	0.214	0.473
62BM	H2	2.195	2.352	1.175		62BM	H2	0.143	0.2	0.446
62BM	C2	2.154	2.47	1.351		62BM	C2	0.092	0.252	0.653
62BM	H3	2.052	2.433	1.347		62BM	H3	0.195	0.288	0.66
62BM	H4	2.187	2.47	1.454		62BM	H4	0.038	0.326	0.712
62BM	C3	2.167	2.61	1.289		62BM	C3	0.079	0.116	0.718
62BM	O1	2.232	2.245	1.347		62BM	O1	0.073	0.389	0.438
62BM	C4	2.311	2.144	1.288		62BM	C4	0.063	0.385	0.295
62BM	H5	2.417	2.172	1.287		62BM	H5	-0.042	0.37	0.27
62BM	H6	2.303	2.051	1.344		62BM	H6	0.081	0.489	0.267
62BM	H7	2.281	2.123	1.185		62BM	H7	0.114	0.31	0.234
62BM	H8	2.173	2.602	1.181		62BM	H8	-0.026	0.09	0.736
62BM	H9	2.262	2.654	1.32		62BM	H9	0.118	0.126	0.82
62BM	C5	2.053	2.709	1.32		62BM	C5	0.144	-0.006	0.659
62BM	H10	2.03	2.722	1.425		62BM	H10	0.105	-0.018	0.558
62BM	H11	2.08	2.807	1.283		62BM	H11	0.253	-0.005	0.662
62BM	H12	1.961	2.681	1.269		62BM	H12	0.105	-0.087	0.721
63BM	C1	0.79	0.284	0.183		63BM	C1	2.652	1	2.128
63BM	H1	0.747	0.265	0.084		63BM	H1	2.65	1.003	2.019
63BM	H2	0.718	0.248	0.257		63BM	H2	2.732	1.073	2.14
63BM	C2	0.817	0.433	0.202		63BM	C2	2.67	0.853	2.185
63BM	H3	0.856	0.45	0.302		63BM	H3	2.673	0.854	2.294
63BM	H4	0.896	0.463	0.133		63BM	H4	2.576	0.801	2.164
63BM	C3	0.695	0.523	0.182		63BM	C3	2.779	0.762	2.135
63BM	O1	0.913	0.216	0.196		63BM	O1	2.526	1.052	2.177
63BM	C4	0.902	0.076	0.177		63BM	C4	2.511	1.189	2.126
63BM	H5	0.871	0.053	0.075		63BM	H5	2.427	1.236	2.176
63BM	H6	0.998	0.029	0.195		63BM	H6	2.591	1.254	2.161
63BM	H7	0.83	0.032	0.246		63BM	H7	2.485	1.189	2.02
63BM	H8	0.62	0.501	0.259		63BM	H8	2.874	0.799	2.173
63BM	H9	0.648	0.501	0.087		63BM	H9	2.789	0.758	2.027
63BM	C5	0.732	0.672	0.185		63BM	C5	2.766	0.617	2.181
63BM	H10	0.797	0.699	0.102		63BM	H10	2.786	0.605	2.288
63BM	H11	0.643	0.735	0.179		63BM	H11	2.666	0.576	2.179
63BM	H12	0.785	0.697	0.277		63BM	H12	2.836	0.551	2.13
64BM	C1	0.907	0.876	2.522		64BM	C1	0.923	0.398	1.071
64BM	H1	0.854	0.956	2.47		64BM	H1	0.814	0.409	1.073
64BM	H2	0.845	0.787	2.516		64BM	H2	0.924	0.296	1.108
64BM	C2	0.929	0.916	2.668		64BM	C2	0.969	0.496	1.176
64BM	H3	0.986	0.838	2.719		64BM	H3	1.074	0.487	1.203
64BM	H4	0.99	1.006	2.672		64BM	H4	0.955	0.589	1.122
64BM	C3	0.796	0.941	2.74		64BM	C3	0.887	0.475	1.306
64BM	O1	1.033	0.852	2.46		64BM	O1	0.978	0.428	0.944
64BM	C4	1.018	0.826	2.322		64BM	C4	0.947	0.338	0.844
64BM	H5	0.963	0.905	2.271		64BM	H5	0.981	0.239	0.876
64BM	H6	1.115	0.818	2.274		64BM	H6	0.839	0.327	0.831
64BM	H7	0.964	0.732	2.306		64BM	H7	0.994	0.364	0.75
64BM	H8	0.734	0.852	2.734		64BM	H8	0.886	0.37	1.337
64BM	H9	0.74	1.02	2.689		64BM	H9	0.789	0.509	1.273
64BM	C5	0.814	0.981	2.887		64BM	C5	0.916	0.564	1.43
64BM	H10	0.872	1.073	2.896		64BM	H10	0.991	0.513	1.491
64BM	H11	0.717	1	2.934		64BM	H11	0.959	0.661	1.409
64BM	H12	0.864	0.903	2.944		64BM	H12	0.828	0.58	1.492
65BM	C1	0.494	1.212	0.786		65BM	C1	0.166	1.814	0.806
65BM	H1	0.429	1.213	0.698		65BM	H1	0.221	1.893	0.755
65BM	H2	0.433	1.229	0.874		65BM	H2	0.099	1.766	0.734
65BM	C2	0.598	1.324	0.772		65BM	C2	0.078	1.871	0.919
65BM	H3	0.671	1.31	0.851		65BM	H3	0.14	1.913	0.998
65BM	H4	0.653	1.314	0.679		65BM	H4	0.024	1.955	0.874
65BM	C3	0.534	1.463	0.785		65BM	C3	-0.015	1.769	0.98
65BM	O1	0.559	1.088	0.797		65BM	O1	0.257	1.712	0.836
65BM	C4	0.472	0.982	0.832		65BM	C4	0.322	1.65	0.721
65BM	H5	0.394	0.967	0.757		65BM	H5	0.372	1.728	0.664
65BM	H6	0.528	0.889	0.839		65BM	H6	0.391	1.574	0.758
65BM	H7	0.425	0.999	0.929		65BM	H7	0.251	1.605	0.652
65BM	H8	0.465	1.464	0.869		65BM	H8	0.021	1.712	1.066
65BM	H9	0.477	1.487	0.696		65BM	H9	-0.061	1.698	0.911
65BM	C5	0.637	1.574	0.809		65BM	C5	-0.133	1.836	1.046
65BM	H10	0.7	1.588	0.722		65BM	H10	-0.104	1.928	1.098
65BM	H11	0.587	1.669	0.83		65BM	H11	-0.216	1.87	0.984
65BM	H12	0.701	1.551	0.895		65BM	H12	-0.174	1.761	1.113
66BM	C1	1.585	0.261	1.934		66BM	C1	2.049	0.184	1.971
66BM	H1	1.487	0.296	1.9		66BM	H1	2.131	0.196	2.042
66BM	H2	1.582	0.252	2.042		66BM	H2	1.959	0.18	2.033
66BM	C2	1.691	0.362	1.89		66BM	C2	2.068	0.048	1.897
66BM	H3	1.79	0.323	1.914		66BM	H3	2.163	0.033	1.846
66BM	H4	1.688	0.372	1.782		66BM	H4	2.079	-0.03	1.973
66BM	C3	1.671	0.498	1.957		66BM	C3	1.945	0.009	1.811
66BM	O1	1.613	0.134	1.877		66BM	O1	2.042	0.294	1.884
66BM	C4	1.51	0.041	1.905		66BM	C4	2.172	0.333	1.842
66BM	H5	1.413	0.076	1.871		66BM	H5	2.163	0.408	1.764
66BM	H6	1.53	-0.053	1.854		66BM	H6	2.238	0.356	1.925
66BM	H7	1.503	0.02	2.012		66BM	H7	2.217	0.25	1.787
66BM	H8	1.675	0.487	2.065		66BM	H8	1.924	0.089	1.74
66BM	H9	1.571	0.536	1.934		66BM	H9	1.856	-0.009	1.872
66BM	C5	1.774	0.603	1.913		66BM	C5	1.972	-0.118	1.729
66BM	H10	1.769	0.62	1.805		66BM	H10	1.892	-0.122	1.654
66BM	H11	1.757	0.698	1.963		66BM	H11	2.064	-0.118	1.672
66BM	H12	1.876	0.571	1.937		66BM	H12	1.964	-0.206	1.792
67BM	C1	1.853	0.688	0.449		67BM	C1	2.621	2.943	0.41
67BM	H1	1.751	0.675	0.485		67BM	H1	2.611	2.92	0.304
67BM	H2	1.872	0.613	0.372		67BM	H2	2.522	2.969	0.448
67BM	C2	1.953	0.671	0.564		67BM	C2	2.706	3.075	0.409
67BM	H3	2.053	0.679	0.524		67BM	H3	2.734	3.088	0.514
67BM	H4	1.942	0.753	0.635		67BM	H4	2.801	3.055	0.359
67BM	C3	1.94	0.536	0.636		67BM	C3	2.638	3.204	0.367
67BM	O1	1.865	0.818	0.395		67BM	O1	2.682	2.838	0.487
67BM	C4	1.777	0.841	0.286		67BM	C4	2.623	2.713	0.452
67BM	H5	1.673	0.831	0.317		67BM	H5	2.515	2.715	0.465
67BM	H6	1.791	0.942	0.248		67BM	H6	2.633	2.69	0.346
67BM	H7	1.796	0.771	0.205		67BM	H7	2.648	2.62	0.502
67BM	H8	1.958	0.455	0.565		67BM	H8	2.58	3.25	0.447
67BM	H9	1.838	0.525	0.672		67BM	H9	2.56	3.194	0.292
67BM	C5	2.035	0.521	0.755		67BM	C5	2.74	3.31	0.337
67BM	H10	2.024	0.602	0.826		67BM	H10	2.78	3.346	0.432
67BM	H11	2.019	0.427	0.808		67BM	H11	2.825	3.274	0.279
67BM	H12	2.139	0.521	0.722		67BM	H12	2.696	3.393	0.281
68BM	C1	0.226	0.809	1.368		68BM	C1	1.97	0.077	1.134
68BM	H1	0.32	0.836	1.414		68BM	H1	2.054	0.011	1.159
68BM	H2	0.17	0.901	1.348		68BM	H2	1.935	0.041	1.038
68BM	C2	0.146	0.716	1.461		68BM	C2	2.028	0.214	1.122
68BM	H3	0.053	0.688	1.413		68BM	H3	1.945	0.275	1.085
68BM	H4	0.2	0.622	1.472		68BM	H4	2.044	0.267	1.216
68BM	C3	0.118	0.777	1.599		68BM	C3	2.144	0.226	1.023
68BM	O1	0.248	0.74	1.247		68BM	O1	1.869	0.07	1.234
68BM	C4	0.331	0.812	1.157		68BM	C4	1.742	0.105	1.188
68BM	H5	0.428	0.833	1.201		68BM	H5	1.734	0.213	1.17
68BM	H6	0.347	0.752	1.067		68BM	H6	1.72	0.04	1.103
68BM	H7	0.285	0.906	1.127		68BM	H7	1.668	0.091	1.267
68BM	H8	0.066	0.872	1.588		68BM	H8	2.105	0.186	0.929
68BM	H9	0.212	0.8	1.649		68BM	H9	2.228	0.173	1.068
68BM	C5	0.036	0.683	1.688		68BM	C5	2.19	0.367	0.987
68BM	H10	0.09	0.59	1.707		68BM	H10	2.25	0.403	1.07
68BM	H11	0.014	0.729	1.784		68BM	H11	2.254	0.358	0.899
68BM	H12	-0.058	0.654	1.641		68BM	H12	2.112	0.444	0.982
69BM	C1	2.255	1.696	2.019		69BM	C1	2.859	0.569	0.575
69BM	H1	2.224	1.677	2.122		69BM	H1	2.949	0.508	0.589
69BM	H2	2.191	1.635	1.954		69BM	H2	2.779	0.496	0.58
69BM	C2	2.401	1.656	1.998		69BM	C2	2.864	0.62	0.436
69BM	H3	2.433	1.684	1.897		69BM	H3	2.872	0.547	0.356
69BM	H4	2.464	1.715	2.066		69BM	H4	2.767	0.669	0.423
69BM	C3	2.424	1.506	2.021		69BM	C3	2.988	0.712	0.408
69BM	O1	2.241	1.833	1.988		69BM	O1	2.827	0.667	0.668
69BM	C4	2.105	1.873	1.976		69BM	C4	2.819	0.635	0.806
69BM	H5	2.049	1.851	2.067		69BM	H5	2.816	0.731	0.858
69BM	H6	2.1	1.981	1.959		69BM	H6	2.729	0.578	0.829
69BM	H7	2.057	1.824	1.892		69BM	H7	2.909	0.583	0.837
69BM	H8	2.369	1.45	1.945		69BM	H8	3.084	0.663	0.414
69BM	H9	2.382	1.477	2.117		69BM	H9	2.985	0.802	0.47
69BM	C5	2.571	1.466	2.016		69BM	C5	2.99	0.764	0.261
69BM	H10	2.627	1.514	2.097		69BM	H10	3.08	0.823	0.245
69BM	H11	2.583	1.358	2.029		69BM	H11	2.988	0.677	0.195
69BM	H12	2.618	1.494	1.922		69BM	H12	2.9	0.821	0.235
70BM	C1	1.106	2.32	0.139		70BM	C1	0.493	1.978	0.014
70BM	H1	1.085	2.223	0.185		70BM	H1	0.449	1.923	0.098
70BM	H2	1.16	2.38	0.213		70BM	H2	0.489	1.921	-0.079
70BM	C2	0.974	2.389	0.102		70BM	C2	0.641	2.021	0.05
70BM	H3	0.995	2.484	0.054		70BM	H3	0.695	2.058	-0.036
70BM	H4	0.923	2.327	0.029		70BM	H4	0.625	2.103	0.121
70BM	C3	0.883	2.41	0.224		70BM	C3	0.725	1.912	0.127
70BM	O1	1.185	2.304	0.022		70BM	O1	0.414	2.09	0.008
70BM	C4	1.305	2.233	0.05		70BM	C4	0.431	2.161	-0.122
70BM	H5	1.284	2.133	0.088		70BM	H5	0.376	2.254	-0.136
70BM	H6	1.364	2.223	-0.041		70BM	H6	0.535	2.191	-0.137
70BM	H7	1.366	2.286	0.124		70BM	H7	0.409	2.103	-0.212
70BM	H8	0.933	2.475	0.296		70BM	H8	0.756	1.838	0.053
70BM	H9	0.869	2.315	0.275		70BM	H9	0.688	1.855	0.213
70BM	C5	0.747	2.469	0.188		70BM	C5	0.849	1.978	0.184
70BM	H10	0.693	2.404	0.119		70BM	H10	0.826	2.031	0.277
70BM	H11	0.685	2.479	0.277		70BM	H11	0.918	1.9	0.214
70BM	H12	0.757	2.567	0.143		70BM	H12	0.903	2.05	0.123
71BM	C1	1.191	2.317	1.294		71BM	C1	0.957	2.9	1.807
71BM	H1	1.26	2.238	1.265		71BM	H1	0.849	2.907	1.824
71BM	H2	1.131	2.278	1.377		71BM	H2	0.995	2.886	1.908
71BM	C2	1.097	2.348	1.177		71BM	C2	1.01	3.033	1.764
71BM	H3	1.012	2.405	1.215		71BM	H3	0.999	3.092	1.854
71BM	H4	1.146	2.412	1.103		71BM	H4	1.118	3.025	1.761
71BM	C3	1.045	2.222	1.108		71BM	C3	0.939	3.091	1.632
71BM	O1	1.265	2.432	1.33		71BM	O1	0.987	2.791	1.727
71BM	C4	1.327	2.413	1.457		71BM	C4	0.922	2.668	1.76
71BM	H5	1.396	2.329	1.456		71BM	H5	0.926	2.593	1.681
71BM	H6	1.382	2.501	1.489		71BM	H6	0.948	2.618	1.852
71BM	H7	1.253	2.392	1.534		71BM	H7	0.816	2.694	1.767
71BM	H8	0.975	2.169	1.173		71BM	H8	0.832	3.108	1.649
71BM	H9	1.126	2.152	1.088		71BM	H9	0.955	3.022	1.549
71BM	C5	0.978	2.254	0.975		71BM	C5	1	3.226	1.589
71BM	H10	1.046	2.306	0.907		71BM	H10	0.925	3.272	1.524
71BM	H11	0.943	2.165	0.924		71BM	H11	1.008	3.302	1.666
71BM	H12	0.892	2.317	0.994		71BM	H12	1.097	3.223	1.541
72BM	C1	2.385	0.622	2.774		72BM	C1	2.38	2.42	1.036
72BM	H1	2.358	0.679	2.686		72BM	H1	2.376	2.412	1.144
72BM	H2	2.377	0.689	2.86		72BM	H2	2.477	2.382	1.003
72BM	C2	2.529	0.573	2.761		72BM	C2	2.362	2.565	1.009
72BM	H3	2.554	0.511	2.847		72BM	H3	2.255	2.581	1.022
72BM	H4	2.538	0.51	2.673		72BM	H4	2.396	2.619	1.097
72BM	C3	2.628	0.69	2.754		72BM	C3	2.417	2.621	0.874
72BM	O1	2.3	0.51	2.789		72BM	O1	2.274	2.352	0.983
72BM	C4	2.168	0.547	2.822		72BM	C4	2.282	2.212	0.997
72BM	H5	2.121	0.601	2.739		72BM	H5	2.312	2.185	1.098
72BM	H6	2.109	0.458	2.843		72BM	H6	2.189	2.173	0.956
72BM	H7	2.164	0.61	2.911		72BM	H7	2.357	2.164	0.934
72BM	H8	2.634	0.737	2.852		72BM	H8	2.359	2.586	0.789
72BM	H9	2.591	0.767	2.686		72BM	H9	2.517	2.581	0.853
72BM	C5	2.768	0.647	2.709		72BM	C5	2.421	2.776	0.886
72BM	H10	2.768	0.603	2.61		72BM	H10	2.478	2.814	0.8
72BM	H11	2.835	0.733	2.706		72BM	H11	2.321	2.818	0.884
72BM	H12	2.812	0.574	2.777		72BM	H12	2.472	2.823	0.971
73BM	C1	1.255	0.191	2.875		73BM	C1	0.63	1.173	2.409
73BM	H1	1.171	0.232	2.932		73BM	H1	0.569	1.094	2.366
73BM	H2	1.312	0.128	2.944		73BM	H2	0.677	1.24	2.336
73BM	C2	1.341	0.306	2.823		73BM	C2	0.732	1.11	2.505
73BM	H3	1.286	0.36	2.746		73BM	H3	0.796	1.185	2.552
73BM	H4	1.356	0.378	2.904		73BM	H4	0.686	1.047	2.581
73BM	C3	1.479	0.261	2.773		73BM	C3	0.828	1.017	2.433
73BM	O1	1.207	0.116	2.764		73BM	O1	0.55	1.261	2.492
73BM	C4	1.113	0.018	2.805		73BM	C4	0.475	1.355	2.414
73BM	H5	1.028	0.062	2.858		73BM	H5	0.41	1.316	2.336
73BM	H6	1.072	-0.036	2.719		73BM	H6	0.41	1.415	2.479
73BM	H7	1.159	-0.056	2.87		73BM	H7	0.545	1.427	2.371
73BM	H8	1.476	0.16	2.733		73BM	H8	0.888	1.077	2.364
73BM	H9	1.547	0.255	2.858		73BM	H9	0.77	0.945	2.374
73BM	C5	1.536	0.357	2.668		73BM	C5	0.922	0.944	2.522
73BM	H10	1.544	0.459	2.708		73BM	H10	0.868	0.877	2.588
73BM	H11	1.636	0.326	2.636		73BM	H11	0.997	0.888	2.467
73BM	H12	1.473	0.362	2.579		73BM	H12	0.982	1.018	2.575
74BM	C1	2.751	1.951	2.668		74BM	C1	2.458	0.408	2.489
74BM	H1	2.672	2.025	2.682		74BM	H1	2.566	0.392	2.488
74BM	H2	2.812	1.949	2.758		74BM	H2	2.418	0.426	2.589
74BM	C2	2.835	1.992	2.546		74BM	C2	2.375	0.299	2.424
74BM	H3	2.913	1.918	2.528		74BM	H3	2.403	0.209	2.478
74BM	H4	2.771	1.992	2.458		74BM	H4	2.269	0.323	2.428
74BM	C3	2.9	2.13	2.561		74BM	C3	2.403	0.279	2.277
74BM	O1	2.695	1.823	2.644		74BM	O1	2.443	0.526	2.41
74BM	C4	2.59	1.791	2.733		74BM	C4	2.505	0.637	2.474
74BM	H5	2.506	1.859	2.72		74BM	H5	2.609	0.627	2.506
74BM	H6	2.554	1.69	2.711		74BM	H6	2.519	0.715	2.399
74BM	H7	2.623	1.794	2.837		74BM	H7	2.449	0.681	2.556
74BM	H8	2.969	2.13	2.645		74BM	H8	2.51	0.274	2.255
74BM	H9	2.823	2.204	2.585		74BM	H9	2.357	0.361	2.222
74BM	C5	2.973	2.174	2.434		74BM	C5	2.334	0.151	2.223
74BM	H10	2.906	2.18	2.348		74BM	H10	2.359	0.138	2.117
74BM	H11	3.018	2.273	2.447		74BM	H11	2.376	0.061	2.266
74BM	H12	3.054	2.106	2.409		74BM	H12	2.226	0.165	2.226
75BM	C1	0.944	0.054	0.993		75BM	C1	2.338	0.279	0.025
75BM	H1	0.876	0.072	1.077		75BM	H1	2.343	0.248	0.13
75BM	H2	0.964	0.15	0.946		75BM	H2	2.425	0.339	-0.003
75BM	C2	0.878	-0.039	0.892		75BM	C2	2.214	0.359	-0.004
75BM	H3	0.952	-0.07	0.818		75BM	H3	2.22	0.392	-0.108
75BM	H4	0.845	-0.13	0.942		75BM	H4	2.136	0.284	0.004
75BM	C3	0.76	0.031	0.822		75BM	C3	2.2	0.479	0.089
75BM	O1	1.067	0.002	1.039		75BM	O1	2.334	0.162	-0.046
75BM	C4	1.129	0.093	1.129		75BM	C4	2.414	0.17	-0.163
75BM	H5	1.068	0.108	1.218		75BM	H5	2.354	0.203	-0.247
75BM	H6	1.225	0.055	1.16		75BM	H6	2.502	0.233	-0.163
75BM	H7	1.146	0.19	1.082		75BM	H7	2.455	0.072	-0.189
75BM	H8	0.793	0.131	0.793		75BM	H8	2.272	0.559	0.078
75BM	H9	0.68	0.049	0.894		75BM	H9	2.218	0.432	0.186
75BM	C5	0.707	-0.04	0.697		75BM	C5	2.054	0.525	0.073
75BM	H10	0.652	-0.13	0.72		75BM	H10	2.042	0.567	-0.026
75BM	H11	0.639	0.026	0.643		75BM	H11	1.981	0.443	0.077
75BM	H12	0.787	-0.067	0.629		75BM	H12	2.03	0.584	0.162
76BM	C1	0.528	0.685	0.474		76BM	C1	1.715	2.231	0.395
76BM	H1	0.622	0.63	0.46		76BM	H1	1.765	2.185	0.309
76BM	H2	0.481	0.695	0.376		76BM	H2	1.756	2.332	0.395
76BM	C2	0.559	0.822	0.535		76BM	C2	1.754	2.147	0.52
76BM	H3	0.465	0.877	0.548		76BM	H3	1.862	2.154	0.535
76BM	H4	0.6	0.807	0.635		76BM	H4	1.689	2.179	0.601
76BM	C3	0.657	0.905	0.452		76BM	C3	1.735	1.989	0.496
76BM	O1	0.443	0.615	0.563		76BM	O1	1.581	2.223	0.363
76BM	C4	0.434	0.477	0.534		76BM	C4	1.539	2.307	0.262
76BM	H5	0.532	0.429	0.543		76BM	H5	1.558	2.408	0.299
76BM	H6	0.368	0.429	0.606		76BM	H6	1.604	2.291	0.176
76BM	H7	0.395	0.459	0.434		76BM	H7	1.436	2.298	0.229
76BM	H8	0.614	0.926	0.354		76BM	H8	1.81	1.948	0.43
76BM	H9	0.748	0.849	0.435		76BM	H9	1.647	1.962	0.438
76BM	C5	0.695	1.037	0.522		76BM	C5	1.741	1.904	0.623
76BM	H10	0.744	1.018	0.618		76BM	H10	1.833	1.921	0.678
76BM	H11	0.764	1.096	0.462		76BM	H11	1.653	1.937	0.679
76BM	H12	0.607	1.098	0.542		76BM	H12	1.739	1.801	0.589
77BM	C1	2.557	2.92	0.925		77BM	C1	2.064	0.599	2.345
77BM	H1	2.55	3.004	0.856		77BM	H1	2.019	0.568	2.439
77BM	H2	2.523	2.831	0.873		77BM	H2	2.169	0.571	2.359
77BM	C2	2.473	2.947	1.05		77BM	C2	2.06	0.741	2.33
77BM	H3	2.486	2.865	1.12		77BM	H3	2.09	0.77	2.229
77BM	H4	2.512	3.036	1.099		77BM	H4	1.957	0.776	2.343
77BM	C3	2.324	2.966	1.017		77BM	C3	2.162	0.805	2.422
77BM	O1	2.691	2.903	0.969		77BM	O1	2.008	0.535	2.231
77BM	C4	2.782	2.893	0.862		77BM	C4	1.952	0.409	2.256
77BM	H5	2.782	2.983	0.801		77BM	H5	2.025	0.336	2.293
77BM	H6	2.883	2.88	0.902		77BM	H6	1.863	0.416	2.319
77BM	H7	2.759	2.808	0.798		77BM	H7	1.898	0.362	2.175
77BM	H8	2.286	2.873	0.974		77BM	H8	2.257	0.753	2.416
77BM	H9	2.313	3.042	0.94		77BM	H9	2.144	0.804	2.53
77BM	C5	2.24	3.003	1.138		77BM	C5	2.187	0.954	2.383
77BM	H10	2.268	3.1	1.177		77BM	H10	2.104	1.024	2.392
77BM	H11	2.135	3.006	1.11		77BM	H11	2.266	0.985	2.452
77BM	H12	2.253	2.929	1.218		77BM	H12	2.235	0.964	2.286
78BM	C1	2.538	1.114	0.221		78BM	C1	0.004	1.142	0.683
78BM	H1	2.468	1.069	0.291		78BM	H1	0.061	1.14	0.776
78BM	H2	2.533	1.057	0.128		78BM	H2	0.067	1.143	0.594
78BM	C2	2.68	1.109	0.279		78BM	C2	-0.102	1.257	0.686
78BM	H3	2.75	1.155	0.208		78BM	H3	-0.152	1.244	0.59
78BM	H4	2.683	1.17	0.37		78BM	H4	-0.169	1.263	0.771
78BM	C3	2.724	0.966	0.31		78BM	C3	-0.035	1.39	0.673
78BM	O1	2.504	1.25	0.197		78BM	O1	-0.067	1.019	0.694
78BM	C4	2.372	1.265	0.149		78BM	C4	0.006	0.907	0.735
78BM	H5	2.299	1.222	0.218		78BM	H5	-0.057	0.818	0.73
78BM	H6	2.348	1.371	0.139		78BM	H6	0.09	0.883	0.67
78BM	H7	2.36	1.219	0.051		78BM	H7	0.042	0.915	0.837
78BM	H8	2.72	0.906	0.219		78BM	H8	0.021	1.382	0.58
78BM	H9	2.654	0.92	0.38		78BM	H9	0.031	1.409	0.757
78BM	C5	2.866	0.958	0.37		78BM	C5	-0.14	1.507	0.666
78BM	H10	2.872	1.013	0.463		78BM	H10	-0.098	1.603	0.696
78BM	H11	2.892	0.854	0.392		78BM	H11	-0.188	1.507	0.568
78BM	H12	2.94	0.997	0.301		78BM	H12	-0.214	1.496	0.746
79BM	C1	0.331	0.662	1.963		79BM	C1	0.463	0.821	1.832
79BM	H1	0.421	0.697	1.911		79BM	H1	0.547	0.886	1.857
79BM	H2	0.354	0.657	2.069		79BM	H2	0.39	0.901	1.819
79BM	C2	0.29	0.525	1.907		79BM	C2	0.437	0.724	1.947
79BM	H3	0.193	0.496	1.948		79BM	H3	0.363	0.652	1.912
79BM	H4	0.276	0.537	1.8		79BM	H4	0.529	0.676	1.979
79BM	C3	0.392	0.414	1.93		79BM	C3	0.388	0.787	2.075
79BM	O1	0.222	0.75	1.94		79BM	O1	0.48	0.75	1.707
79BM	C4	0.259	0.887	1.946		79BM	C4	0.563	0.814	1.613
79BM	H5	0.323	0.913	1.862		79BM	H5	0.668	0.808	1.64
79BM	H6	0.171	0.95	1.941		79BM	H6	0.538	0.771	1.516
79BM	H7	0.312	0.91	2.038		79BM	H7	0.529	0.918	1.61
79BM	H8	0.393	0.383	2.034		79BM	H8	0.342	0.712	2.139
79BM	H9	0.492	0.451	1.91		79BM	H9	0.306	0.858	2.062
79BM	C5	0.366	0.293	1.839		79BM	C5	0.495	0.854	2.156
79BM	H10	0.363	0.321	1.734		79BM	H10	0.449	0.888	2.248
79BM	H11	0.445	0.218	1.849		79BM	H11	0.574	0.787	2.191
79BM	H12	0.271	0.244	1.863		79BM	H12	0.541	0.938	2.103
80BM	C1	0.455	2.564	0.798		80BM	C1	0.553	2.384	1.397
80BM	H1	0.385	2.616	0.864		80BM	H1	0.638	2.36	1.332
80BM	H2	0.398	2.489	0.743		80BM	H2	0.599	2.351	1.49
80BM	C2	0.566	2.496	0.879		80BM	C2	0.435	2.297	1.35
80BM	H3	0.628	2.436	0.812		80BM	H3	0.435	2.197	1.391
80BM	H4	0.631	2.568	0.928		80BM	H4	0.347	2.352	1.384
80BM	C3	0.512	2.407	0.99		80BM	C3	0.43	2.285	1.194
80BM	O1	0.52	2.655	0.711		80BM	O1	0.525	2.524	1.397
80BM	C4	0.431	2.717	0.62		80BM	C4	0.426	2.565	1.49
80BM	H5	0.358	2.781	0.67		80BM	H5	0.404	2.5	1.574
80BM	H6	0.489	2.778	0.551		80BM	H6	0.455	2.657	1.541
80BM	H7	0.377	2.644	0.559		80BM	H7	0.334	2.576	1.433
80BM	H8	0.447	2.332	0.946		80BM	H8	0.524	2.241	1.16
80BM	H9	0.453	2.466	1.06		80BM	H9	0.439	2.38	1.141
80BM	C5	0.626	2.338	1.064		80BM	C5	0.311	2.205	1.13
80BM	H10	0.695	2.409	1.11		80BM	H10	0.312	2.212	1.021
80BM	H11	0.589	2.274	1.144		80BM	H11	0.318	2.097	1.148
80BM	H12	0.682	2.273	0.997		80BM	H12	0.218	2.25	1.164
81BM	C1	0.105	0.524	2.792		81BM	C1	2.36	1.596	0.079
81BM	H1	0.204	0.568	2.794		81BM	H1	2.349	1.491	0.052
81BM	H2	0.047	0.571	2.872		81BM	H2	2.29	1.62	0.158
81BM	C2	0.114	0.373	2.812		81BM	C2	2.327	1.683	-0.037
81BM	H3	0.016	0.328	2.797		81BM	H3	2.389	1.657	-0.123
81BM	H4	0.177	0.332	2.733		81BM	H4	2.226	1.678	-0.076
81BM	C3	0.17	0.334	2.949		81BM	C3	2.338	1.837	-0.005
81BM	O1	0.042	0.548	2.668		81BM	O1	2.496	1.614	0.1
81BM	C4	0.053	0.684	2.627		81BM	C4	2.549	1.578	0.225
81BM	H5	0.156	0.712	2.607		81BM	H5	2.541	1.665	0.29
81BM	H6	-0.004	0.699	2.535		81BM	H6	2.491	1.496	0.267
81BM	H7	0.012	0.751	2.703		81BM	H7	2.655	1.551	0.222
81BM	H8	0.106	0.373	3.028		81BM	H8	2.432	1.858	0.045
81BM	H9	0.267	0.382	2.964		81BM	H9	2.262	1.866	0.068
81BM	C5	0.185	0.183	2.965		81BM	C5	2.336	1.93	-0.124
81BM	H10	0.251	0.142	2.888		81BM	H10	2.435	1.931	-0.169
81BM	H11	0.229	0.157	3.062		81BM	H11	2.256	1.908	-0.195
81BM	H12	0.089	0.132	2.958		81BM	H12	2.315	2.03	-0.086
82BM	C1	0.894	0.393	2.574		82BM	C1	1.659	1.21	2.675
82BM	H1	0.839	0.479	2.616		82BM	H1	1.624	1.213	2.778
82BM	H2	0.886	0.402	2.466		82BM	H2	1.587	1.159	2.61
82BM	C2	0.828	0.263	2.622		82BM	C2	1.791	1.127	2.677
82BM	H3	0.899	0.181	2.613		82BM	H3	1.825	1.106	2.575
82BM	H4	0.804	0.269	2.728		82BM	H4	1.872	1.18	2.726
82BM	C3	0.702	0.228	2.542		82BM	C3	1.776	0.994	2.758
82BM	O1	1.03	0.397	2.613		82BM	O1	1.683	1.34	2.624
82BM	C4	1.092	0.518	2.571		82BM	C4	1.561	1.418	2.612
82BM	H5	1.042	0.605	2.615		82BM	H5	1.581	1.522	2.585
82BM	H6	1.196	0.521	2.601		82BM	H6	1.491	1.37	2.544
82BM	H7	1.088	0.529	2.462		82BM	H7	1.521	1.429	2.713
82BM	H8	0.72	0.241	2.435		82BM	H8	1.694	0.935	2.717
82BM	H9	0.622	0.298	2.568		82BM	H9	1.747	1.016	2.861
82BM	C5	0.654	0.085	2.566		82BM	C5	1.9	0.907	2.778
82BM	H10	0.624	0.07	2.67		82BM	H10	1.982	0.974	2.803
82BM	H11	0.568	0.062	2.504		82BM	H11	1.886	0.847	2.868
82BM	H12	0.732	0.012	2.543		82BM	H12	1.934	0.841	2.698
83BM	C1	0.514	1.239	0.292		83BM	C1	2.122	0.816	1.301
83BM	H1	0.457	1.232	0.199		83BM	H1	2.226	0.846	1.317
83BM	H2	0.514	1.139	0.336		83BM	H2	2.108	0.833	1.195
83BM	C2	0.449	1.34	0.386		83BM	C2	2.034	0.903	1.384
83BM	H3	0.511	1.352	0.475		83BM	H3	2.045	0.865	1.486
83BM	H4	0.448	1.437	0.338		83BM	H4	2.085	0.999	1.377
83BM	C3	0.307	1.299	0.428		83BM	C3	1.885	0.895	1.34
83BM	O1	0.646	1.282	0.264		83BM	O1	2.098	0.681	1.339
83BM	C4	0.717	1.195	0.177		83BM	C4	2.149	0.574	1.259
83BM	H5	0.665	1.179	0.083		83BM	H5	2.252	0.561	1.29
83BM	H6	0.814	1.239	0.153		83BM	H6	2.093	0.483	1.281
83BM	H7	0.735	1.098	0.223		83BM	H7	2.139	0.595	1.152
83BM	H8	0.312	1.209	0.489		83BM	H8	1.856	0.791	1.325
83BM	H9	0.249	1.272	0.339		83BM	H9	1.883	0.928	1.236
83BM	C5	0.233	1.409	0.504		83BM	C5	1.786	0.964	1.433
83BM	H10	0.219	1.499	0.444		83BM	H10	1.684	0.938	1.404
83BM	H11	0.134	1.376	0.537		83BM	H11	1.805	0.925	1.533
83BM	H12	0.289	1.44	0.592		83BM	H12	1.799	1.072	1.435
84BM	C1	0.143	1.738	2.44		84BM	C1	0.041	1.939	2.372
84BM	H1	0.048	1.725	2.389		84BM	H1	-0.013	2.032	2.391
84BM	H2	0.181	1.831	2.397		84BM	H2	0.124	1.957	2.305
84BM	C2	0.238	1.625	2.401		84BM	C2	-0.053	1.84	2.304
84BM	H3	0.342	1.659	2.412		84BM	H3	0.006	1.755	2.272
84BM	H4	0.229	1.539	2.467		84BM	H4	-0.122	1.8	2.378
84BM	C3	0.211	1.579	2.257		84BM	C3	-0.129	1.903	2.191
84BM	O1	0.122	1.743	2.581		84BM	O1	0.09	1.884	2.495
84BM	C4	0.179	1.864	2.632		84BM	C4	0.179	1.96	2.564
84BM	H5	0.134	1.951	2.585		84BM	H5	0.274	1.963	2.51
84BM	H6	0.167	1.877	2.739		84BM	H6	0.147	2.064	2.577
84BM	H7	0.287	1.867	2.612		84BM	H7	0.194	1.923	2.665
84BM	H8	0.21	1.665	2.189		84BM	H8	-0.065	1.963	2.126
84BM	H9	0.112	1.535	2.253		84BM	H9	-0.197	1.98	2.229
84BM	C5	0.312	1.477	2.205		84BM	C5	-0.2	1.796	2.104
84BM	H10	0.322	1.392	2.273		84BM	H10	-0.279	1.733	2.145
84BM	H11	0.283	1.438	2.108		84BM	H11	-0.245	1.842	2.016
84BM	H12	0.411	1.521	2.193		84BM	H12	-0.126	1.727	2.064
85BM	C1	2.859	1.536	2.644		85BM	C1	1.591	2.28	1.439
85BM	H1	2.86	1.427	2.647		85BM	H1	1.658	2.244	1.361
85BM	H2	2.755	1.567	2.66		85BM	H2	1.632	2.375	1.472
85BM	C2	2.907	1.588	2.51		85BM	C2	1.574	2.18	1.55
85BM	H3	2.923	1.695	2.521		85BM	H3	1.664	2.163	1.609
85BM	H4	3.001	1.54	2.482		85BM	H4	1.504	2.225	1.621
85BM	C3	2.806	1.569	2.397		85BM	C3	1.531	2.043	1.517
85BM	O1	2.944	1.593	2.742		85BM	O1	1.461	2.311	1.396
85BM	C4	2.887	1.574	2.872		85BM	C4	1.446	2.417	1.304
85BM	H5	2.872	1.468	2.895		85BM	H5	1.455	2.514	1.353
85BM	H6	2.949	1.615	2.951		85BM	H6	1.518	2.412	1.222
85BM	H7	2.79	1.623	2.88		85BM	H7	1.348	2.404	1.26
85BM	H8	2.708	1.604	2.428		85BM	H8	1.599	2.003	1.443
85BM	H9	2.796	1.463	2.374		85BM	H9	1.435	2.041	1.465
85BM	C5	2.85	1.647	2.273		85BM	C5	1.542	1.953	1.634
85BM	H10	2.941	1.604	2.229		85BM	H10	1.538	1.851	1.594
85BM	H11	2.773	1.647	2.196		85BM	H11	1.634	1.953	1.692
85BM	H12	2.873	1.75	2.297		85BM	H12	1.458	1.967	1.703
86BM	C1	2.863	1.945	1.659		86BM	C1	1.521	0.512	0.352
86BM	H1	2.941	1.918	1.73		86BM	H1	1.575	0.595	0.305
86BM	H2	2.893	1.908	1.561		86BM	H2	1.575	0.421	0.325
86BM	C2	2.848	2.097	1.653		86BM	C2	1.378	0.496	0.293
86BM	H3	2.776	2.123	1.575		86BM	H3	1.331	0.415	0.349
86BM	H4	2.807	2.135	1.747		86BM	H4	1.335	0.593	0.32
86BM	C3	2.983	2.165	1.624		86BM	C3	1.371	0.456	0.145
86BM	O1	2.743	1.885	1.702		86BM	O1	1.513	0.508	0.488
86BM	C4	2.743	1.745	1.682		86BM	C4	1.632	0.529	0.556
86BM	H5	2.833	1.699	1.725		86BM	H5	1.611	0.554	0.66
86BM	H6	2.656	1.701	1.73		86BM	H6	1.704	0.448	0.548
86BM	H7	2.74	1.721	1.576		86BM	H7	1.683	0.611	0.504
86BM	H8	3.02	2.129	1.528		86BM	H8	1.419	0.361	0.12
86BM	H9	3.054	2.133	1.7		86BM	H9	1.432	0.525	0.088
86BM	C5	2.982	2.318	1.622		86BM	C5	1.226	0.44	0.096
86BM	H10	2.938	2.359	1.713		86BM	H10	1.221	0.404	-0.006
86BM	H11	3.083	2.357	1.613		86BM	H11	1.168	0.381	0.167
86BM	H12	2.926	2.355	1.536		86BM	H12	1.179	0.538	0.107
87BM	C1	0.595	1.443	1.764		87BM	C1	2.126	0.033	0.347
87BM	H1	0.506	1.503	1.785		87BM	H1	2.16	0.1	0.268
87BM	H2	0.609	1.374	1.847		87BM	H2	2.035	-0.019	0.317
87BM	C2	0.719	1.532	1.751		87BM	C2	2.1	0.122	0.475
87BM	H3	0.804	1.471	1.721		87BM	H3	2.186	0.175	0.515
87BM	H4	0.703	1.605	1.672		87BM	H4	2.033	0.202	0.443
87BM	C3	0.753	1.602	1.884		87BM	C3	2.027	0.045	0.587
87BM	O1	0.578	1.371	1.644		87BM	O1	2.234	-0.06	0.37
87BM	C4	0.479	1.27	1.656		87BM	C4	2.278	-0.119	0.245
87BM	H5	0.383	1.314	1.681		87BM	H5	2.196	-0.159	0.185
87BM	H6	0.468	1.217	1.561		87BM	H6	2.334	-0.045	0.188
87BM	H7	0.506	1.197	1.732		87BM	H7	2.334	-0.21	0.266
87BM	H8	0.76	1.527	1.963		87BM	H8	2.103	-0.016	0.636
87BM	H9	0.671	1.668	1.911		87BM	H9	1.952	-0.022	0.545
87BM	C5	0.885	1.68	1.877		87BM	C5	1.965	0.153	0.674
87BM	H10	0.881	1.758	1.801		87BM	H10	1.943	0.107	0.771
87BM	H11	0.906	1.729	1.973		87BM	H11	2.039	0.231	0.693
87BM	H12	0.969	1.615	1.855		87BM	H12	1.873	0.195	0.632
88BM	C1	2.291	1.455	0.777		88BM	C1	2.328	0.764	0.724
88BM	H1	2.249	1.354	0.785		88BM	H1	2.405	0.813	0.784
88BM	H2	2.221	1.524	0.822		88BM	H2	2.31	0.672	0.78
88BM	C2	2.316	1.489	0.63		88BM	C2	2.395	0.73	0.581
88BM	H3	2.37	1.583	0.624		88BM	H3	2.32	0.722	0.502
88BM	H4	2.383	1.414	0.587		88BM	H4	2.447	0.826	0.571
88BM	C3	2.187	1.497	0.547		88BM	C3	2.5	0.624	0.565
88BM	O1	2.416	1.462	0.843		88BM	O1	2.204	0.831	0.713
88BM	C4	2.411	1.413	0.976		88BM	C4	2.155	0.887	0.826
88BM	H5	2.381	1.309	0.979		88BM	H5	2.062	0.943	0.819
88BM	H6	2.511	1.42	1.021		88BM	H6	2.14	0.822	0.912
88BM	H7	2.343	1.472	1.037		88BM	H7	2.227	0.964	0.856
88BM	H8	2.121	1.574	0.588		88BM	H8	2.565	0.627	0.652
88BM	H9	2.134	1.403	0.553		88BM	H9	2.56	0.644	0.476
88BM	C5	2.216	1.528	0.4		88BM	C5	2.434	0.482	0.551
88BM	H10	2.28	1.452	0.356		88BM	H10	2.385	0.448	0.642
88BM	H11	2.124	1.533	0.341		88BM	H11	2.362	0.473	0.47
88BM	H12	2.267	1.624	0.389		88BM	H12	2.507	0.404	0.533
89BM	C1	2.196	1.943	0.377		89BM	C1	1.86	1.912	2.43
89BM	H1	2.102	1.916	0.327		89BM	H1	1.85	2.006	2.377
89BM	H2	2.224	1.859	0.441		89BM	H2	1.817	1.831	2.37
89BM	C2	2.18	2.068	0.463		89BM	C2	1.79	1.92	2.563
89BM	H3	2.278	2.096	0.499		89BM	H3	1.682	1.916	2.552
89BM	H4	2.145	2.151	0.402		89BM	H4	1.824	1.834	2.62
89BM	C3	2.084	2.048	0.582		89BM	C3	1.826	2.046	2.641
89BM	O1	2.297	1.968	0.28		89BM	O1	1.996	1.896	2.443
89BM	C4	2.352	1.847	0.229		89BM	C4	2.046	1.856	2.319
89BM	H5	2.276	1.784	0.183		89BM	H5	1.995	1.774	2.267
89BM	H6	2.428	1.868	0.154		89BM	H6	2.036	1.946	2.259
89BM	H7	2.401	1.79	0.307		89BM	H7	2.153	1.836	2.319
89BM	H8	2.098	1.948	0.624		89BM	H8	1.931	2.076	2.644
89BM	H9	1.981	2.053	0.548		89BM	H9	1.797	2.048	2.746
89BM	C5	2.106	2.152	0.692		89BM	C5	1.75	2.169	2.581
89BM	H10	2.093	2.253	0.653		89BM	H10	1.726	2.256	2.643
89BM	H11	2.035	2.138	0.774		89BM	H11	1.821	2.207	2.508
89BM	H12	2.206	2.146	0.734		89BM	H12	1.66	2.135	2.529
90BM	C1	1.881	2.85	1.032		90BM	C1	1.803	0.66	0.88
90BM	H1	1.92	2.911	0.951		90BM	H1	1.734	0.604	0.942
90BM	H2	1.967	2.807	1.083		90BM	H2	1.891	0.676	0.942
90BM	C2	1.787	2.74	0.982		90BM	C2	1.721	0.783	0.833
90BM	H3	1.727	2.706	1.066		90BM	H3	1.77	0.818	0.742
90BM	H4	1.718	2.782	0.909		90BM	H4	1.62	0.755	0.803
90BM	C3	1.859	2.617	0.924		90BM	C3	1.707	0.889	0.939
90BM	O1	1.803	2.928	1.122		90BM	O1	1.847	0.585	0.769
90BM	C4	1.876	3.028	1.192		90BM	C4	1.969	0.631	0.705
90BM	H5	1.918	3.101	1.123		90BM	H5	1.962	0.737	0.683
90BM	H6	1.808	3.08	1.259		90BM	H6	2.051	0.599	0.77
90BM	H7	1.955	2.985	1.253		90BM	H7	1.977	0.582	0.608
90BM	H8	1.933	2.582	0.997		90BM	H8	1.627	0.951	0.899
90BM	H9	1.915	2.644	0.834		90BM	H9	1.791	0.958	0.952
90BM	C5	1.763	2.502	0.894		90BM	C5	1.661	0.848	1.083
90BM	H10	1.693	2.528	0.814		90BM	H10	1.721	0.764	1.119
90BM	H11	1.817	2.413	0.864		90BM	H11	1.657	0.928	1.158
90BM	H12	1.703	2.476	0.982		90BM	H12	1.557	0.814	1.082
91BM	C1	0.861	1.178	1.657		91BM	C1	1.407	0.533	1.649
91BM	H1	0.938	1.198	1.732		91BM	H1	1.503	0.506	1.693
91BM	H2	0.782	1.25	1.675		91BM	H2	1.414	0.626	1.592
91BM	C2	0.8	1.04	1.674		91BM	C2	1.315	0.538	1.777
91BM	H3	0.742	1.043	1.766		91BM	H3	1.208	0.537	1.757
91BM	H4	0.727	1.023	1.595		91BM	H4	1.339	0.446	1.829
91BM	C3	0.902	0.927	1.683		91BM	C3	1.37	0.65	1.868
91BM	O1	0.912	1.192	1.525		91BM	O1	1.375	0.426	1.552
91BM	C4	0.918	1.328	1.486		91BM	C4	1.242	0.439	1.501
91BM	H5	0.973	1.387	1.559		91BM	H5	1.203	0.54	1.501
91BM	H6	0.966	1.338	1.389		91BM	H6	1.225	0.395	1.403
91BM	H7	0.817	1.37	1.478		91BM	H7	1.183	0.39	1.579
91BM	H8	0.962	0.939	1.773		91BM	H8	1.476	0.647	1.894
91BM	H9	0.97	0.931	1.598		91BM	H9	1.315	0.643	1.961
91BM	C5	0.832	0.791	1.684		91BM	C5	1.35	0.797	1.812
91BM	H10	0.778	0.776	1.591		91BM	H10	1.252	0.829	1.777
91BM	H11	0.902	0.709	1.698		91BM	H11	1.383	0.869	1.887
91BM	H12	0.759	0.787	1.765		91BM	H12	1.414	0.813	1.725
92BM	C1	1.806	2.977	1.722		92BM	C1	2.251	2.366	1.754
92BM	H1	1.781	2.998	1.826		92BM	H1	2.241	2.45	1.686
92BM	H2	1.729	3.029	1.664		92BM	H2	2.167	2.299	1.737
92BM	C2	1.799	2.825	1.699		92BM	C2	2.228	2.419	1.897
92BM	H3	1.797	2.804	1.592		92BM	H3	2.204	2.345	1.973
92BM	H4	1.888	2.778	1.74		92BM	H4	2.32	2.464	1.933
92BM	C3	1.675	2.763	1.765		92BM	C3	2.126	2.532	1.903
92BM	O1	1.937	3.026	1.697		92BM	O1	2.381	2.305	1.743
92BM	C4	1.953	3.061	1.56		92BM	C4	2.454	2.37	1.642
92BM	H5	1.891	3.147	1.534		92BM	H5	2.548	2.316	1.629
92BM	H6	2.056	3.089	1.538		92BM	H6	2.412	2.392	1.544
92BM	H7	1.927	2.979	1.493		92BM	H7	2.488	2.467	1.68
92BM	H8	1.585	2.806	1.722		92BM	H8	2.153	2.617	1.84
92BM	H9	1.671	2.789	1.87		92BM	H9	2.124	2.574	2.003
92BM	C5	1.668	2.61	1.752		92BM	C5	1.978	2.488	1.871
92BM	H10	1.756	2.561	1.793		92BM	H10	1.978	2.418	1.787
92BM	H11	1.581	2.572	1.805		92BM	H11	1.936	2.435	1.957
92BM	H12	1.657	2.579	1.649		92BM	H12	1.909	2.567	1.846
93BM	C1	0.968	0.726	1.327		93BM	C1	1.643	1.712	1.126
93BM	H1	0.913	0.634	1.304		93BM	H1	1.636	1.721	1.017
93BM	H2	0.955	0.742	1.434		93BM	H2	1.748	1.708	1.153
93BM	C2	0.909	0.84	1.243		93BM	C2	1.577	1.587	1.172
93BM	H3	0.979	0.912	1.202		93BM	H3	1.471	1.59	1.148
93BM	H4	0.864	0.796	1.154		93BM	H4	1.621	1.519	1.099
93BM	C3	0.8	0.916	1.32		93BM	C3	1.611	1.549	1.32
93BM	O1	1.106	0.714	1.297		93BM	O1	1.577	1.82	1.181
93BM	C4	1.159	0.589	1.338		93BM	C4	1.629	1.942	1.134
93BM	H5	1.15	0.574	1.445		93BM	H5	1.724	1.984	1.166
93BM	H6	1.109	0.506	1.288		93BM	H6	1.623	1.944	1.025
93BM	H7	1.265	0.583	1.313		93BM	H7	1.554	2.014	1.167
93BM	H8	0.844	0.973	1.402		93BM	H8	1.714	1.575	1.343
93BM	H9	0.729	0.846	1.365		93BM	H9	1.584	1.447	1.345
93BM	C5	0.723	1.012	1.23		93BM	C5	1.54	1.641	1.42
93BM	H10	0.669	0.959	1.151		93BM	H10	1.433	1.649	1.399
93BM	H11	0.649	1.066	1.288		93BM	H11	1.554	1.612	1.524
93BM	H12	0.789	1.085	1.183		93BM	H12	1.574	1.744	1.409
94BM	C1	2.983	2.336	0.546		94BM	C1	1.623	0.219	0.803
94BM	H1	3.079	2.311	0.592		94BM	H1	1.696	0.221	0.884
94BM	H2	2.918	2.249	0.559		94BM	H2	1.664	0.249	0.707
94BM	C2	2.997	2.362	0.396		94BM	C2	1.503	0.31	0.843
94BM	H3	2.9	2.395	0.358		94BM	H3	1.527	0.416	0.835
94BM	H4	3.067	2.443	0.375		94BM	H4	1.428	0.289	0.767
94BM	C3	3.041	2.237	0.318		94BM	C3	1.438	0.279	0.976
94BM	O1	2.925	2.451	0.605		94BM	O1	1.574	0.086	0.796
94BM	C4	2.847	2.419	0.719		94BM	C4	1.664	-0.008	0.743
94BM	H5	2.906	2.371	0.797		94BM	H5	1.7	0.016	0.643
94BM	H6	2.801	2.509	0.761		94BM	H6	1.743	-0.013	0.817
94BM	H7	2.765	2.35	0.695		94BM	H7	1.613	-0.105	0.743
94BM	H8	3	2.147	0.363		94BM	H8	1.493	0.32	1.06
94BM	H9	3.149	2.227	0.323		94BM	H9	1.443	0.171	0.993
94BM	C5	2.998	2.242	0.171		94BM	C5	1.293	0.328	0.981
94BM	H10	3.04	2.329	0.121		94BM	H10	1.243	0.329	1.078
94BM	H11	3.033	2.153	0.118		94BM	H11	1.288	0.43	0.941
94BM	H12	2.89	2.246	0.162		94BM	H12	1.232	0.276	0.907
95BM	C1	0.743	1.358	2.544		95BM	C1	2.618	0.929	0.945
95BM	H1	0.752	1.416	2.452		95BM	H1	2.583	0.828	0.925
95BM	H2	0.723	1.428	2.625		95BM	H2	2.725	0.926	0.925
95BM	C2	0.872	1.279	2.569		95BM	C2	2.583	0.996	1.081
95BM	H3	0.866	1.233	2.668		95BM	H3	2.652	0.959	1.157
95BM	H4	0.877	1.197	2.497		95BM	H4	2.614	1.101	1.078
95BM	C3	0.997	1.366	2.556		95BM	C3	2.431	0.976	1.113
95BM	O1	0.638	1.264	2.531		95BM	O1	2.548	1.01	0.854
95BM	C4	0.52	1.323	2.48		95BM	C4	2.608	1.019	0.728
95BM	H5	0.532	1.348	2.375		95BM	H5	2.662	0.933	0.689
95BM	H6	0.439	1.251	2.489		95BM	H6	2.538	1.047	0.65
95BM	H7	0.492	1.412	2.535		95BM	H7	2.692	1.089	0.723
95BM	H8	0.995	1.443	2.633		95BM	H8	2.405	0.871	1.124
95BM	H9	0.996	1.419	2.461		95BM	H9	2.37	1.021	1.034
95BM	C5	1.126	1.284	2.566		95BM	C5	2.398	1.058	1.243
95BM	H10	1.13	1.207	2.49		95BM	H10	2.461	1.024	1.325
95BM	H11	1.212	1.349	2.553		95BM	H11	2.408	1.167	1.235
95BM	H12	1.134	1.236	2.664		95BM	H12	2.293	1.039	1.267
96BM	C1	0.229	2.69	1.556		96BM	C1	2.626	1.673	1.656
96BM	H1	0.201	2.591	1.59		96BM	H1	2.569	1.603	1.596
96BM	H2	0.338	2.697	1.555		96BM	H2	2.593	1.662	1.759
96BM	C2	0.173	2.795	1.652		96BM	C2	2.595	1.82	1.624
96BM	H3	0.204	2.895	1.62		96BM	H3	2.625	1.836	1.52
96BM	H4	0.064	2.794	1.644		96BM	H4	2.487	1.83	1.626
96BM	C3	0.217	2.769	1.797		96BM	C3	2.67	1.918	1.719
96BM	O1	0.177	2.711	1.427		96BM	O1	2.762	1.662	1.631
96BM	C4	0.234	2.624	1.331		96BM	C4	2.806	1.525	1.632
96BM	H5	0.219	2.519	1.357		96BM	H5	2.794	1.485	1.733
96BM	H6	0.189	2.641	1.234		96BM	H6	2.735	1.461	1.579
96BM	H7	0.342	2.642	1.321		96BM	H7	2.905	1.528	1.587
96BM	H8	0.325	2.783	1.805		96BM	H8	2.778	1.912	1.707
96BM	H9	0.198	2.665	1.824		96BM	H9	2.658	1.883	1.822
96BM	C5	0.146	2.861	1.898		96BM	C5	2.629	2.065	1.701
96BM	H10	0.039	2.844	1.899		96BM	H10	2.683	2.135	1.765
96BM	H11	0.185	2.845	1.998		96BM	H11	2.645	2.1	1.6
96BM	H12	0.163	2.966	1.872		96BM	H12	2.524	2.078	1.727
97BM	C1	2.168	2.332	0.161		97BM	C1	2.788	2.303	2.798
97BM	H1	2.154	2.334	0.269		97BM	H1	2.793	2.408	2.827
97BM	H2	2.158	2.436	0.128		97BM	H2	2.731	2.302	2.705
97BM	C2	2.058	2.244	0.101		97BM	C2	2.719	2.236	2.916
97BM	H3	2.059	2.253	-0.008		97BM	H3	2.711	2.13	2.89
97BM	H4	2.081	2.139	0.123		97BM	H4	2.786	2.254	3
97BM	C3	1.919	2.279	0.157		97BM	C3	2.581	2.302	2.945
97BM	O1	2.298	2.283	0.13		97BM	O1	2.907	2.236	2.78
97BM	C4	2.387	2.304	0.239		97BM	C4	2.988	2.306	2.695
97BM	H5	2.393	2.41	0.266		97BM	H5	2.982	2.271	2.593
97BM	H6	2.356	2.249	0.328		97BM	H6	2.983	2.415	2.689
97BM	H7	2.488	2.269	0.216		97BM	H7	3.09	2.277	2.721
97BM	H8	1.9	2.386	0.149		97BM	H8	2.513	2.299	2.86
97BM	H9	1.918	2.258	0.264		97BM	H9	2.589	2.407	2.975
97BM	C5	1.804	2.203	0.091		97BM	C5	2.524	2.228	3.06
97BM	H10	1.819	2.095	0.094		97BM	H10	2.501	2.124	3.037
97BM	H11	1.71	2.224	0.142		97BM	H11	2.583	2.223	3.152
97BM	H12	1.791	2.231	-0.013		97BM	H12	2.425	2.268	3.087
98BM	C1	2.036	2.599	0.4		98BM	C1	2.069	1.786	1.651
98BM	H1	2.023	2.687	0.462		98BM	H1	2.095	1.702	1.587
98BM	H2	1.969	2.608	0.314		98BM	H2	2.127	1.871	1.613
98BM	C2	2.002	2.474	0.482		98BM	C2	2.107	1.761	1.803
98BM	H3	2.023	2.384	0.424		98BM	H3	2.056	1.67	1.836
98BM	H4	2.068	2.47	0.568		98BM	H4	2.213	1.744	1.823
98BM	C3	1.856	2.47	0.528		98BM	C3	2.05	1.877	1.889
98BM	O1	2.17	2.587	0.355		98BM	O1	1.924	1.794	1.633
98BM	C4	2.221	2.707	0.3		98BM	C4	1.89	1.82	1.501
98BM	H5	2.223	2.787	0.375		98BM	H5	1.94	1.746	1.438
98BM	H6	2.323	2.692	0.266		98BM	H6	1.784	1.821	1.479
98BM	H7	2.161	2.741	0.215		98BM	H7	1.943	1.913	1.48
98BM	H8	1.79	2.497	0.446		98BM	H8	2.058	1.839	1.991
98BM	H9	1.842	2.544	0.606		98BM	H9	1.942	1.884	1.875
98BM	C5	1.815	2.333	0.582		98BM	C5	2.138	2.005	1.886
98BM	H10	1.871	2.306	0.671		98BM	H10	2.242	1.977	1.865
98BM	H11	1.709	2.334	0.609		98BM	H11	2.102	2.059	1.798
98BM	H12	1.83	2.255	0.508		98BM	H12	2.122	2.068	1.972
99BM	C1	2.726	2.449	3.005		99BM	C1	0.725	2.425	0.307
99BM	H1	2.791	2.434	3.091		99BM	H1	0.691	2.322	0.296
99BM	H2	2.777	2.521	2.939		99BM	H2	0.823	2.408	0.351
99BM	C2	2.59	2.503	3.048		99BM	C2	0.639	2.51	0.394
99BM	H3	2.544	2.438	3.123		99BM	H3	0.663	2.615	0.379
99BM	H4	2.606	2.597	3.102		99BM	H4	0.535	2.504	0.362
99BM	C3	2.498	2.533	2.929		99BM	C3	0.648	2.476	0.546
99BM	O1	2.699	2.327	2.938		99BM	O1	0.735	2.479	0.175
99BM	C4	2.817	2.263	2.894		99BM	C4	0.852	2.425	0.108
99BM	H5	2.88	2.235	2.978		99BM	H5	0.922	2.372	0.172
99BM	H6	2.793	2.171	2.84		99BM	H6	0.824	2.351	0.032
99BM	H7	2.875	2.325	2.826		99BM	H7	0.9	2.514	0.067
99BM	H8	2.519	2.474	2.84		99BM	H8	0.749	2.511	0.568
99BM	H9	2.521	2.635	2.899		99BM	H9	0.655	2.369	0.567
99BM	C5	2.349	2.529	2.963		99BM	C5	0.551	2.548	0.639
99BM	H10	2.326	2.591	3.05		99BM	H10	0.449	2.522	0.612
99BM	H11	2.29	2.566	2.88		99BM	H11	0.58	2.532	0.743
99BM	H12	2.313	2.428	2.985		99BM	H12	0.566	2.655	0.634
100BM	C1	2.68	1.94	2.165		100BM	C1	3.019	0.227	2.491
100BM	H1	2.68	1.856	2.096		100BM	H1	3.048	0.144	2.427
100BM	H2	2.761	1.926	2.236		100BM	H2	3.084	0.313	2.475
100BM	C2	2.547	1.948	2.239		100BM	C2	3.046	0.179	2.632
100BM	H3	2.542	2.042	2.293		100BM	H3	3.15	0.153	2.648
100BM	H4	2.465	1.948	2.167		100BM	H4	3.036	0.263	2.702
100BM	C3	2.529	1.831	2.337		100BM	C3	2.957	0.059	2.671
100BM	O1	2.704	2.061	2.095		100BM	O1	2.876	0.241	2.476
100BM	C4	2.828	2.056	2.026		100BM	C4	2.851	0.31	2.354
100BM	H5	2.828	1.978	1.95		100BM	H5	2.871	0.246	2.268
100BM	H6	2.848	2.151	1.977		100BM	H6	2.747	0.34	2.352
100BM	H7	2.912	2.037	2.094		100BM	H7	2.905	0.404	2.349
100BM	H8	2.614	1.827	2.405		100BM	H8	2.968	-0.023	2.6
100BM	H9	2.53	1.736	2.284		100BM	H9	2.85	0.081	2.668
100BM	C5	2.401	1.841	2.421		100BM	C5	2.988	0.009	2.811
100BM	H10	2.312	1.83	2.358		100BM	H10	3.09	-0.029	2.817
100BM	H11	2.398	1.762	2.495		100BM	H11	2.984	0.095	2.877
100BM	H12	2.394	1.936	2.473		100BM	H12	2.925	-0.076	2.839
101BM	C1	2.753	1.05	1.576		101BM	C1	1.983	1.524	0.018
101BM	H1	2.663	1	1.612		101BM	H1	2.063	1.571	0.075
101BM	H2	2.821	1.057	1.661		101BM	H2	1.887	1.573	0.036
101BM	C2	2.717	1.191	1.528		101BM	C2	1.954	1.381	0.058
101BM	H3	2.805	1.239	1.485		101BM	H3	1.95	1.38	0.167
101BM	H4	2.643	1.184	1.448		101BM	H4	1.858	1.34	0.026
101BM	C3	2.663	1.276	1.643		101BM	C3	2.064	1.275	0.024
101BM	O1	2.815	0.975	1.472		101BM	O1	2.007	1.528	-0.123
101BM	C4	2.833	0.842	1.516		101BM	C4	1.889	1.504	-0.205
101BM	H5	2.868	0.837	1.619		101BM	H5	1.81	1.574	-0.177
101BM	H6	2.74	0.785	1.51		101BM	H6	1.912	1.521	-0.31
101BM	H7	2.907	0.79	1.455		101BM	H7	1.858	1.401	-0.187
101BM	H8	2.741	1.287	1.719		101BM	H8	2.132	1.278	0.109
101BM	H9	2.58	1.225	1.692		101BM	H9	2.123	1.31	-0.06
101BM	C5	2.617	1.415	1.597		101BM	C5	2.01	1.129	0.027
101BM	H10	2.537	1.408	1.524		101BM	H10	1.946	1.116	-0.06
101BM	H11	2.58	1.473	1.682		101BM	H11	2.088	1.053	0.021
101BM	H12	2.699	1.47	1.552		101BM	H12	1.957	1.118	0.122
102BM	C1	1.279	0.863	1.552		102BM	C1	0.159	2.34	0.782
102BM	H1	1.25	0.898	1.651		102BM	H1	0.215	2.248	0.798
102BM	H2	1.267	0.755	1.553		102BM	H2	0.23	2.423	0.774
102BM	C2	1.425	0.897	1.521		102BM	C2	0.041	2.357	0.879
102BM	H3	1.447	0.874	1.417		102BM	H3	0.076	2.382	0.979
102BM	H4	1.441	1.004	1.534		102BM	H4	-0.01	2.447	0.845
102BM	C3	1.524	0.822	1.611		102BM	C3	-0.046	2.228	0.892
102BM	O1	1.194	0.916	1.451		102BM	O1	0.1	2.316	0.654
102BM	C4	1.173	1.056	1.463		102BM	C4	0.191	2.315	0.547
102BM	H5	1.264	1.112	1.445		102BM	H5	0.126	2.297	0.461
102BM	H6	1.099	1.092	1.392		102BM	H6	0.226	2.418	0.54
102BM	H7	1.137	1.082	1.563		102BM	H7	0.269	2.24	0.558
102BM	H8	1.508	0.714	1.602		102BM	H8	0.006	2.16	0.959
102BM	H9	1.506	0.848	1.715		102BM	H9	-0.047	2.185	0.792
102BM	C5	1.669	0.855	1.574		102BM	C5	-0.193	2.253	0.942
102BM	H10	1.691	0.959	1.595		102BM	H10	-0.261	2.29	0.865
102BM	H11	1.738	0.793	1.632		102BM	H11	-0.241	2.16	0.971
102BM	H12	1.689	0.836	1.468		102BM	H12	-0.204	2.304	1.038
103BM	C1	0.847	0.538	0.655		103BM	C1	1.536	2.745	2.426
103BM	H1	0.758	0.536	0.719		103BM	H1	1.608	2.708	2.498
103BM	H2	0.816	0.573	0.557		103BM	H2	1.489	2.657	2.382
103BM	C2	0.908	0.398	0.645		103BM	C2	1.588	2.834	2.321
103BM	H3	1.004	0.406	0.594		103BM	H3	1.514	2.881	2.255
103BM	H4	0.929	0.361	0.745		103BM	H4	1.641	2.917	2.368
103BM	C3	0.817	0.3	0.569		103BM	C3	1.691	2.758	2.234
103BM	O1	0.945	0.626	0.707		103BM	O1	1.434	2.814	2.495
103BM	C4	0.893	0.757	0.722		103BM	C4	1.483	2.921	2.579
103BM	H5	0.809	0.76	0.792		103BM	H5	1.559	2.901	2.654
103BM	H6	0.969	0.825	0.759		103BM	H6	1.531	3.001	2.522
103BM	H7	0.86	0.798	0.627		103BM	H7	1.396	2.967	2.626
103BM	H8	0.775	0.349	0.481		103BM	H8	1.661	2.661	2.194
103BM	H9	0.732	0.274	0.631		103BM	H9	1.778	2.736	2.296
103BM	C5	0.893	0.175	0.524		103BM	C5	1.739	2.849	2.117
103BM	H10	0.935	0.121	0.608		103BM	H10	1.828	2.808	2.07
103BM	H11	0.826	0.107	0.471		103BM	H11	1.665	2.873	2.041
103BM	H12	0.974	0.199	0.456		103BM	H12	1.773	2.946	2.154
104BM	C1	1.626	0.162	1.073		104BM	C1	1.822	2.795	1.392
104BM	H1	1.701	0.204	1.139		104BM	H1	1.93	2.796	1.379
104BM	H2	1.631	0.053	1.081		104BM	H2	1.8	2.734	1.479
104BM	C2	1.654	0.204	0.929		104BM	C2	1.75	2.716	1.278
104BM	H3	1.578	0.161	0.864		104BM	H3	1.793	2.616	1.275
104BM	H4	1.646	0.312	0.923		104BM	H4	1.647	2.703	1.31
104BM	C3	1.794	0.162	0.88		104BM	C3	1.768	2.785	1.14
104BM	O1	1.498	0.208	1.11		104BM	O1	1.785	2.928	1.414
104BM	C4	1.464	0.171	1.243		104BM	C4	1.668	2.937	1.492
104BM	H5	1.537	0.209	1.315		104BM	H5	1.586	2.873	1.46
104BM	H6	1.367	0.214	1.269		104BM	H6	1.683	2.909	1.596
104BM	H7	1.457	0.063	1.254		104BM	H7	1.627	3.038	1.487
104BM	H8	1.804	0.054	0.886		104BM	H8	1.868	2.825	1.125
104BM	H9	1.869	0.205	0.946		104BM	H9	1.693	2.863	1.13
104BM	C5	1.821	0.209	0.737		104BM	C5	1.732	2.692	1.028
104BM	H10	1.805	0.316	0.728		104BM	H10	1.812	2.618	1.027
104BM	H11	1.925	0.192	0.709		104BM	H11	1.648	2.625	1.046
104BM	H12	1.758	0.159	0.664		104BM	H12	1.722	2.731	0.927
105BM	C1	2.69	2.328	1.097		105BM	C1	1.051	1.29	2.291
105BM	H1	2.676	2.285	1.197		105BM	H1	1.071	1.198	2.236
105BM	H2	2.786	2.291	1.058		105BM	H2	1.015	1.263	2.39
105BM	C2	2.691	2.48	1.106		105BM	C2	0.949	1.375	2.221
105BM	H3	2.703	2.523	1.006		105BM	H3	0.977	1.412	2.122
105BM	H4	2.595	2.515	1.143		105BM	H4	0.871	1.305	2.192
105BM	C3	2.802	2.533	1.197		105BM	C3	0.889	1.508	2.287
105BM	O1	2.584	2.29	1.011		105BM	O1	1.162	1.369	2.294
105BM	C4	2.564	2.151	1.008		105BM	C4	1.256	1.316	2.384
105BM	H5	2.542	2.112	1.107		105BM	H5	1.229	1.36	2.48
105BM	H6	2.479	2.127	0.944		105BM	H6	1.243	1.209	2.401
105BM	H7	2.652	2.098	0.969		105BM	H7	1.359	1.345	2.361
105BM	H8	2.9	2.497	1.164		105BM	H8	0.97	1.582	2.295
105BM	H9	2.79	2.491	1.297		105BM	H9	0.85	1.473	2.382
105BM	C5	2.803	2.685	1.206		105BM	C5	0.779	1.565	2.203
105BM	H10	2.707	2.724	1.242		105BM	H10	0.692	1.501	2.189
105BM	H11	2.879	2.719	1.276		105BM	H11	0.747	1.665	2.234
105BM	H12	2.824	2.732	1.11		105BM	H12	0.826	1.587	2.107
106BM	C1	2.588	0.284	1.208		106BM	C1	2.493	3.027	1.778
106BM	H1	2.599	0.185	1.252		106BM	H1	2.481	3.075	1.68
106BM	H2	2.503	0.276	1.139		106BM	H2	2.4	3.042	1.833
106BM	C2	2.717	0.315	1.131		106BM	C2	2.611	3.095	1.845
106BM	H3	2.711	0.413	1.084		106BM	H3	2.64	3.048	1.939
106BM	H4	2.802	0.32	1.2		106BM	H4	2.696	3.095	1.777
106BM	C3	2.745	0.211	1.022		106BM	C3	2.57	3.242	1.882
106BM	O1	2.562	0.38	1.31		106BM	O1	2.527	2.894	1.777
106BM	C4	2.499	0.497	1.259		106BM	C4	2.483	2.822	1.891
106BM	H5	2.401	0.474	1.215		106BM	H5	2.516	2.718	1.89
106BM	H6	2.483	0.571	1.338		106BM	H6	2.51	2.862	1.989
106BM	H7	2.558	0.546	1.181		106BM	H7	2.375	2.81	1.893
106BM	H8	2.664	0.21	0.949		106BM	H8	2.49	3.228	1.954
106BM	H9	2.747	0.111	1.066		106BM	H9	2.544	3.287	1.786
106BM	C5	2.878	0.236	0.949		106BM	C5	2.674	3.323	1.95
106BM	H10	2.962	0.23	1.018		106BM	H10	2.639	3.416	1.994
106BM	H11	2.894	0.161	0.871		106BM	H11	2.712	3.271	2.038
106BM	H12	2.88	0.334	0.903		106BM	H12	2.761	3.346	1.889
107BM	C1	2.552	2.814	0.506		107BM	C1	1.332	0.818	1.306
107BM	H1	2.447	2.84	0.513		107BM	H1	1.407	0.858	1.238
107BM	H2	2.579	2.814	0.4		107BM	H2	1.246	0.853	1.249
107BM	C2	2.578	2.677	0.567		107BM	C2	1.352	0.885	1.439
107BM	H3	2.683	2.65	0.552		107BM	H3	1.288	0.824	1.501
107BM	H4	2.564	2.683	0.675		107BM	H4	1.453	0.865	1.474
107BM	C3	2.487	2.568	0.509		107BM	C3	1.328	1.039	1.428
107BM	O1	2.63	2.909	0.576		107BM	O1	1.33	0.675	1.32
107BM	C4	2.619	3.04	0.524		107BM	C4	1.333	0.602	1.194
107BM	H5	2.516	3.076	0.526		107BM	H5	1.244	0.627	1.137
107BM	H6	2.679	3.109	0.583		107BM	H6	1.425	0.632	1.144
107BM	H7	2.655	3.045	0.421		107BM	H7	1.335	0.499	1.23
107BM	H8	2.494	2.569	0.4		107BM	H8	1.23	1.065	1.387
107BM	H9	2.383	2.592	0.533		107BM	H9	1.388	1.09	1.352
107BM	C5	2.52	2.428	0.56		107BM	C5	1.325	1.102	1.563
107BM	H10	2.524	2.424	0.669		107BM	H10	1.263	1.043	1.631
107BM	H11	2.446	2.354	0.529		107BM	H11	1.425	1.098	1.607
107BM	H12	2.617	2.394	0.523		107BM	H12	1.289	1.205	1.565
108BM	C1	2.239	1.069	2.018		108BM	C1	2.762	2.793	0.007
108BM	H1	2.309	1.094	2.098		108BM	H1	2.745	2.793	-0.101
108BM	H2	2.288	1.093	1.923		108BM	H2	2.854	2.85	0.023
108BM	C2	2.109	1.148	2.034		108BM	C2	2.777	2.664	0.088
108BM	H3	2.039	1.121	1.956		108BM	H3	2.78	2.699	0.192
108BM	H4	2.06	1.116	2.127		108BM	H4	2.692	2.598	0.075
108BM	C3	2.132	1.299	2.035		108BM	C3	2.898	2.577	0.061
108BM	O1	2.208	0.931	2.022		108BM	O1	2.651	2.865	0.065
108BM	C4	2.323	0.848	2.021		108BM	C4	2.639	2.996	0.018
108BM	H5	2.39	0.872	2.103		108BM	H5	2.729	3.057	0.021
108BM	H6	2.293	0.743	2.033		108BM	H6	2.624	2.989	-0.09
108BM	H7	2.378	0.856	1.928		108BM	H7	2.556	3.048	0.067
108BM	H8	2.167	1.332	1.937		108BM	H8	2.983	2.644	0.05
108BM	H9	2.21	1.324	2.106		108BM	H9	2.876	2.521	-0.03
108BM	C5	2.006	1.379	2.072		108BM	C5	2.951	2.491	0.177
108BM	H10	1.973	1.358	2.173		108BM	H10	2.873	2.422	0.207
108BM	H11	2.024	1.486	2.065		108BM	H11	3.046	2.44	0.162
108BM	H12	1.923	1.357	2.005		108BM	H12	2.962	2.558	0.263
109BM	C1	2.867	1.683	0.93		109BM	C1	1.017	2.154	1.456
109BM	H1	2.928	1.627	0.859		109BM	H1	1.001	2.169	1.349
109BM	H2	2.764	1.673	0.896		109BM	H2	1.053	2.254	1.479
109BM	C2	2.911	1.829	0.928		109BM	C2	1.135	2.055	1.473
109BM	H3	2.874	1.882	1.016		109BM	H3	1.215	2.098	1.414
109BM	H4	3.02	1.835	0.934		109BM	H4	1.172	2.042	1.575
109BM	C3	2.861	1.903	0.803		109BM	C3	1.118	1.921	1.395
109BM	O1	2.879	1.63	1.062		109BM	O1	0.899	2.127	1.533
109BM	C4	2.866	1.488	1.06		109BM	C4	0.925	2.14	1.671
109BM	H5	2.945	1.444	1.001		109BM	H5	0.976	2.235	1.692
109BM	H6	2.874	1.446	1.161		109BM	H6	0.833	2.119	1.725
109BM	H7	2.771	1.456	1.017		109BM	H7	0.988	2.056	1.699
109BM	H8	2.752	1.898	0.8		109BM	H8	1.094	1.949	1.293
109BM	H9	2.897	1.853	0.713		109BM	H9	1.042	1.854	1.435
109BM	C5	2.904	2.05	0.801		109BM	C5	1.247	1.85	1.389
109BM	H10	3.012	2.061	0.788		109BM	H10	1.247	1.747	1.352
109BM	H11	2.855	2.102	0.718		109BM	H11	1.324	1.9	1.331
109BM	H12	2.876	2.102	0.893		109BM	H12	1.298	1.835	1.484
110BM	C1	0.473	2.771	2.625		110BM	C1	0.954	2.161	2.467
110BM	H1	0.382	2.717	2.653		110BM	H1	0.908	2.18	2.564
110BM	H2	0.519	2.717	2.542		110BM	H2	0.922	2.059	2.445
110BM	C2	0.567	2.78	2.745		110BM	C2	1.112	2.158	2.47
110BM	H3	0.656	2.835	2.716		110BM	H3	1.148	2.075	2.53
110BM	H4	0.519	2.839	2.823		110BM	H4	1.148	2.133	2.371
110BM	C3	0.605	2.642	2.801		110BM	C3	1.17	2.296	2.506
110BM	O1	0.439	2.902	2.586		110BM	O1	0.895	2.248	2.375
110BM	C4	0.337	2.904	2.487		110BM	C4	0.881	2.199	2.239
110BM	H5	0.244	2.861	2.524		110BM	H5	0.983	2.192	2.199
110BM	H6	0.317	3.007	2.458		110BM	H6	0.819	2.11	2.25
110BM	H7	0.367	2.849	2.397		110BM	H7	0.829	2.267	2.172
110BM	H8	0.654	2.583	2.723		110BM	H8	1.165	2.307	2.615
110BM	H9	0.515	2.587	2.829		110BM	H9	1.118	2.38	2.461
110BM	C5	0.697	2.651	2.922		110BM	C5	1.323	2.311	2.475
110BM	H10	0.647	2.698	3.007		110BM	H10	1.376	2.22	2.5
110BM	H11	0.729	2.552	2.954		110BM	H11	1.34	2.323	2.368
110BM	H12	0.786	2.709	2.9		110BM	H12	1.374	2.393	2.526
111BM	C1	0.614	1.794	0.356		111BM	C1	1.998	2.798	2.893
111BM	H1	0.679	1.85	0.289		111BM	H1	1.968	2.832	2.793
111BM	H2	0.515	1.84	0.353		111BM	H2	2.087	2.737	2.878
111BM	C2	0.671	1.797	0.497		111BM	C2	1.882	2.705	2.937
111BM	H3	0.611	1.734	0.562		111BM	H3	1.906	2.667	3.036
111BM	H4	0.771	1.753	0.495		111BM	H4	1.788	2.759	2.945
111BM	C3	0.679	1.938	0.556		111BM	C3	1.858	2.582	2.854
111BM	O1	0.606	1.658	0.317		111BM	O1	2.012	2.912	2.98
111BM	C4	0.592	1.641	0.177		111BM	C4	2.132	2.983	2.956
111BM	H5	0.675	1.686	0.123		111BM	H5	2.214	2.916	2.978
111BM	H6	0.591	1.534	0.152		111BM	H6	2.145	3.01	2.851
111BM	H7	0.5	1.685	0.139		111BM	H7	2.129	3.078	3.011
111BM	H8	0.579	1.974	0.578		111BM	H8	1.82	2.505	2.92
111BM	H9	0.722	2.007	0.484		111BM	H9	1.957	2.552	2.822
111BM	C5	0.763	1.941	0.685		111BM	C5	1.762	2.6	2.734
111BM	H10	0.866	1.913	0.666		111BM	H10	1.762	2.503	2.685
111BM	H11	0.763	2.04	0.729		111BM	H11	1.66	2.612	2.771
111BM	H12	0.723	1.872	0.759		111BM	H12	1.793	2.682	2.669
112BM	C1	1.275	1.522	0.154		112BM	C1	1.236	2.655	2.666
112BM	H1	1.353	1.494	0.223		112BM	H1	1.166	2.571	2.671
112BM	H2	1.287	1.457	0.068		112BM	H2	1.324	2.617	2.615
112BM	C2	1.295	1.668	0.111		112BM	C2	1.277	2.722	2.797
112BM	H3	1.223	1.694	0.033		112BM	H3	1.34	2.808	2.776
112BM	H4	1.272	1.734	0.194		112BM	H4	1.184	2.764	2.836
112BM	C3	1.438	1.695	0.064		112BM	C3	1.348	2.628	2.888
112BM	O1	1.146	1.506	0.214		112BM	O1	1.182	2.755	2.584
112BM	C4	1.121	1.369	0.239		112BM	C4	1.041	2.776	2.597
112BM	H5	1.184	1.33	0.32		112BM	H5	1.005	2.802	2.697
112BM	H6	1.017	1.352	0.268		112BM	H6	1.014	2.851	2.523
112BM	H7	1.137	1.307	0.151		112BM	H7	0.997	2.677	2.581
112BM	H8	1.459	1.639	-0.027		112BM	H8	1.375	2.689	2.975
112BM	H9	1.509	1.659	0.138		112BM	H9	1.436	2.596	2.832
112BM	C5	1.463	1.845	0.039		112BM	C5	1.272	2.509	2.945
112BM	H10	1.447	1.903	0.13		112BM	H10	1.342	2.443	2.996
112BM	H11	1.566	1.863	0.006		112BM	H11	1.194	2.538	3.015
112BM	H12	1.396	1.884	-0.037		112BM	H12	1.224	2.448	2.868
113BM	C1	0.884	2.222	2.173		113BM	C1	0.228	2.743	2.588
113BM	H1	0.971	2.272	2.216		113BM	H1	0.167	2.748	2.498
113BM	H2	0.897	2.224	2.065		113BM	H2	0.16	2.7	2.662
113BM	C2	0.755	2.297	2.207		113BM	C2	0.281	2.875	2.648
113BM	H3	0.672	2.25	2.154		113BM	H3	0.363	2.911	2.586
113BM	H4	0.732	2.286	2.313		113BM	H4	0.199	2.944	2.628
113BM	C3	0.763	2.446	2.17		113BM	C3	0.331	2.876	2.796
113BM	O1	0.874	2.089	2.222		113BM	O1	0.335	2.641	2.571
113BM	C4	0.957	2	2.149		113BM	C4	0.409	2.673	2.451
113BM	H5	1.061	2.031	2.151		113BM	H5	0.5	2.613	2.455
113BM	H6	0.95	1.899	2.189		113BM	H6	0.363	2.641	2.358
113BM	H7	0.927	1.995	2.044		113BM	H7	0.441	2.776	2.44
113BM	H8	0.811	2.456	2.073		113BM	H8	0.399	2.795	2.822
113BM	H9	0.826	2.498	2.242		113BM	H9	0.238	2.856	2.849
113BM	C5	0.625	2.513	2.162		113BM	C5	0.381	3.011	2.833
113BM	H10	0.573	2.511	2.257		113BM	H10	0.393	3.021	2.941
113BM	H11	0.633	2.616	2.129		113BM	H11	0.479	3.039	2.795
113BM	H12	0.562	2.462	2.088		113BM	H12	0.31	3.087	2.799
114BM	C1	1.216	1.467	2.849		114BM	C1	1.138	1.757	1.98
114BM	H1	1.269	1.549	2.897		114BM	H1	1.136	1.844	1.914
114BM	H2	1.206	1.493	2.744		114BM	H2	1.223	1.77	2.048
114BM	C2	1.078	1.449	2.914		114BM	C2	1.134	1.624	1.908
114BM	H3	1.021	1.371	2.864		114BM	H3	1.133	1.551	1.989
114BM	H4	1.09	1.415	3.016		114BM	H4	1.036	1.618	1.86
114BM	C3	0.996	1.579	2.915		114BM	C3	1.239	1.606	1.801
114BM	O1	1.287	1.346	2.866		114BM	O1	1.027	1.756	2.07
114BM	C4	1.422	1.356	2.825		114BM	C4	0.981	1.887	2.096
114BM	H5	1.478	1.422	2.891		114BM	H5	0.958	1.948	2.008
114BM	H6	1.469	1.257	2.828		114BM	H6	0.893	1.871	2.158
114BM	H7	1.43	1.393	2.723		114BM	H7	1.049	1.949	2.155
114BM	H8	0.948	1.592	2.818		114BM	H8	1.334	1.618	1.853
114BM	H9	1.06	1.665	2.93		114BM	H9	1.238	1.695	1.738
114BM	C5	0.89	1.581	3.024		114BM	C5	1.227	1.47	1.724
114BM	H10	0.933	1.586	3.124		114BM	H10	1.135	1.474	1.665
114BM	H11	0.825	1.667	3.011		114BM	H11	1.312	1.469	1.656
114BM	H12	0.826	1.492	3.021		114BM	H12	1.238	1.384	1.789
115BM	C1	0.235	1.974	1.607		115BM	C1	0.267	2.361	1.887
115BM	H1	0.167	2.049	1.566		115BM	H1	0.291	2.377	1.782
115BM	H2	0.272	1.923	1.518		115BM	H2	0.309	2.265	1.917
115BM	C2	0.164	1.874	1.699		115BM	C2	0.112	2.358	1.911
115BM	H3	0.106	1.927	1.774		115BM	H3	0.095	2.409	2.006
115BM	H4	0.092	1.817	1.639		115BM	H4	0.066	2.427	1.84
115BM	C3	0.26	1.778	1.77		115BM	C3	0.048	2.215	1.917
115BM	O1	0.342	2.037	1.674		115BM	O1	0.323	2.472	1.955
115BM	C4	0.297	2.127	1.776		115BM	C4	0.298	2.594	1.886
115BM	H5	0.224	2.199	1.738		115BM	H5	0.333	2.673	1.953
115BM	H6	0.253	2.075	1.86		115BM	H6	0.345	2.599	1.787
115BM	H7	0.381	2.184	1.814		115BM	H7	0.192	2.615	1.875
115BM	H8	0.323	1.834	1.839		115BM	H8	0.082	2.164	2.006
115BM	H9	0.329	1.733	1.699		115BM	H9	0.088	2.165	1.828
115BM	C5	0.188	1.667	1.846		115BM	C5	-0.11	2.209	1.916
115BM	H10	0.133	1.604	1.777		115BM	H10	-0.138	2.104	1.914
115BM	H11	0.261	1.603	1.897		115BM	H11	-0.166	2.252	2
115BM	H12	0.12	1.707	1.921		115BM	H12	-0.159	2.248	1.827
116BM	C1	2.355	2.131	2.887		116BM	C1	0.523	2.843	0.142
116BM	H1	2.355	2.025	2.86		116BM	H1	0.552	2.948	0.148
116BM	H2	2.277	2.144	2.962		116BM	H2	0.493	2.826	0.039
116BM	C2	2.323	2.214	2.762		116BM	C2	0.405	2.833	0.237
116BM	H3	2.335	2.32	2.782		116BM	H3	0.324	2.902	0.218
116BM	H4	2.394	2.19	2.682		116BM	H4	0.367	2.732	0.219
116BM	C3	2.18	2.19	2.712		116BM	C3	0.443	2.84	0.388
116BM	O1	2.48	2.172	2.939		116BM	O1	0.617	2.748	0.182
116BM	C4	2.525	2.083	3.041		116BM	C4	0.748	2.804	0.192
116BM	H5	2.537	1.982	3.003		116BM	H5	0.824	2.73	0.213
116BM	H6	2.621	2.114	3.082		116BM	H6	0.776	2.85	0.097
116BM	H7	2.453	2.079	3.124		116BM	H7	0.754	2.875	0.274
116BM	H8	2.11	2.204	2.794		116BM	H8	0.527	2.783	0.427
116BM	H9	2.169	2.087	2.68		116BM	H9	0.352	2.805	0.438
116BM	C5	2.142	2.284	2.598		116BM	C5	0.472	2.981	0.442
116BM	H10	2.206	2.27	2.51		116BM	H10	0.559	3.031	0.4
116BM	H11	2.039	2.266	2.568		116BM	H11	0.386	3.047	0.443
116BM	H12	2.15	2.389	2.628		116BM	H12	0.492	2.961	0.547
117BM	C1	0.843	0.226	1.494		117BM	C1	2.555	0.5	1.637
117BM	H1	0.883	0.132	1.534		117BM	H1	2.637	0.43	1.65
117BM	H2	0.892	0.24	1.398		117BM	H2	2.565	0.555	1.544
117BM	C2	0.878	0.345	1.585		117BM	C2	2.577	0.597	1.757
117BM	H3	0.85	0.438	1.535		117BM	H3	2.548	0.544	1.847
117BM	H4	0.818	0.341	1.677		117BM	H4	2.68	0.628	1.773
117BM	C3	1.027	0.346	1.623		117BM	C3	2.485	0.719	1.756
117BM	O1	0.702	0.217	1.474		117BM	O1	2.425	0.446	1.656
117BM	C4	0.639	0.136	1.574		117BM	C4	2.389	0.367	1.547
117BM	H5	0.649	0.178	1.674		117BM	H5	2.458	0.291	1.511
117BM	H6	0.532	0.126	1.554		117BM	H6	2.306	0.307	1.584
117BM	H7	0.679	0.035	1.575		117BM	H7	2.373	0.43	1.459
117BM	H8	1.088	0.34	1.533		117BM	H8	2.387	0.678	1.731
117BM	H9	1.049	0.256	1.681		117BM	H9	2.519	0.788	1.68
117BM	C5	1.066	0.469	1.705		117BM	C5	2.473	0.783	1.898
117BM	H10	1	0.481	1.791		117BM	H10	2.568	0.826	1.929
117BM	H11	1.168	0.46	1.744		117BM	H11	2.407	0.869	1.9
117BM	H12	1.06	0.56	1.647		117BM	H12	2.45	0.704	1.97
118BM	C1	0.406	0.41	1.343		118BM	C1	1.116	2.831	0.956
118BM	H1	0.397	0.5	1.282		118BM	H1	1.144	2.727	0.973
118BM	H2	0.306	0.385	1.378		118BM	H2	1.043	2.815	0.877
118BM	C2	0.499	0.435	1.461		118BM	C2	1.242	2.909	0.922
118BM	H3	0.496	0.348	1.527		118BM	H3	1.295	2.856	0.842
118BM	H4	0.601	0.447	1.425		118BM	H4	1.22	3.008	0.882
118BM	C3	0.463	0.557	1.544		118BM	C3	1.335	2.926	1.039
118BM	O1	0.463	0.303	1.267		118BM	O1	1.047	2.883	1.064
118BM	C4	0.377	0.271	1.158		118BM	C4	0.977	2.999	1.02
118BM	H5	0.341	0.36	1.106		118BM	H5	0.888	2.985	0.959
118BM	H6	0.429	0.211	1.084		118BM	H6	0.923	3.042	1.105
118BM	H7	0.289	0.215	1.192		118BM	H7	1.027	3.091	0.992
118BM	H8	0.366	0.543	1.59		118BM	H8	1.269	2.943	1.124
118BM	H9	0.457	0.645	1.48		118BM	H9	1.41	3.005	1.036
118BM	C5	0.569	0.578	1.651		118BM	C5	1.405	2.796	1.064
118BM	H10	0.667	0.591	1.606		118BM	H10	1.342	2.707	1.061
118BM	H11	0.547	0.666	1.713		118BM	H11	1.478	2.785	0.983
118BM	H12	0.577	0.491	1.716		118BM	H12	1.45	2.808	1.162
119BM	C1	1.291	1.634	1.318		119BM	C1	1.99	0.631	1.939
119BM	H1	1.223	1.587	1.247		119BM	H1	1.966	0.557	2.014
119BM	H2	1.261	1.739	1.322		119BM	H2	2.092	0.661	1.966
119BM	C2	1.436	1.626	1.272		119BM	C2	1.888	0.75	1.955
119BM	H3	1.491	1.713	1.31		119BM	H3	1.879	0.773	2.061
119BM	H4	1.486	1.54	1.316		119BM	H4	1.94	0.839	1.918
119BM	C3	1.45	1.618	1.119		119BM	C3	1.747	0.746	1.887
119BM	O1	1.275	1.573	1.446		119BM	O1	1.977	0.576	1.809
119BM	C4	1.148	1.61	1.501		119BM	C4	2.062	0.646	1.722
119BM	H5	1.066	1.577	1.438		119BM	H5	2.054	0.614	1.618
119BM	H6	1.133	1.568	1.6		119BM	H6	2.04	0.753	1.717
119BM	H7	1.139	1.718	1.513		119BM	H7	2.166	0.647	1.754
119BM	H8	1.407	1.706	1.072		119BM	H8	1.683	0.666	1.923
119BM	H9	1.391	1.534	1.081		119BM	H9	1.765	0.716	1.783
119BM	C5	1.594	1.599	1.074		119BM	C5	1.675	0.879	1.879
119BM	H10	1.64	1.513	1.122		119BM	H10	1.613	0.9	1.966
119BM	H11	1.6	1.582	0.967		119BM	H11	1.745	0.962	1.874
119BM	H12	1.654	1.687	1.097		119BM	H12	1.61	0.879	1.791
120BM	C1	0.556	0.366	2.921		120BM	C1	2.239	1.022	0.378
120BM	H1	0.501	0.369	3.015		120BM	H1	2.192	1.005	0.281
120BM	H2	0.663	0.369	2.945		120BM	H2	2.325	0.957	0.389
120BM	C2	0.518	0.487	2.835		120BM	C2	2.13	1.018	0.489
120BM	H3	0.582	0.489	2.747		120BM	H3	2.089	0.919	0.472
120BM	H4	0.417	0.473	2.798		120BM	H4	2.181	1.022	0.585
120BM	C3	0.529	0.62	2.912		120BM	C3	2.02	1.132	0.488
120BM	O1	0.525	0.247	2.852		120BM	O1	2.306	1.15	0.383
120BM	C4	0.547	0.131	2.93		120BM	C4	2.394	1.171	0.267
120BM	H5	0.49	0.134	3.023		120BM	H5	2.454	1.261	0.285
120BM	H6	0.514	0.043	2.874		120BM	H6	2.463	1.087	0.257
120BM	H7	0.653	0.118	2.953		120BM	H7	2.342	1.191	0.173
120BM	H8	0.634	0.639	2.936		120BM	H8	1.961	1.124	0.397
120BM	H9	0.476	0.612	3.007		120BM	H9	2.072	1.228	0.477
120BM	C5	0.473	0.74	2.835		120BM	C5	1.921	1.139	0.606
120BM	H10	0.366	0.73	2.815		120BM	H10	1.855	1.225	0.598
120BM	H11	0.488	0.833	2.89		120BM	H11	1.865	1.046	0.616
120BM	H12	0.522	0.753	2.739		120BM	H12	1.979	1.158	0.696
121BM	C1	2.027	2.743	2.964		121BM	C1	1.115	1.026	2.033
121BM	H1	2.135	2.734	2.951		121BM	H1	1.053	1.11	2.063
121BM	H2	2.005	2.713	3.067		121BM	H2	1.149	1.036	1.93
121BM	C2	1.958	2.649	2.864		121BM	C2	1.044	0.89	2.052
121BM	H3	1.852	2.672	2.857		121BM	H3	1.123	0.815	2.047
121BM	H4	1.999	2.665	2.765		121BM	H4	1.018	0.877	2.157
121BM	C3	1.972	2.501	2.904		121BM	C3	0.931	0.876	1.953
121BM	O1	1.983	2.876	2.943		121BM	O1	1.234	1.025	2.117
121BM	C4	2.073	2.971	3		121BM	C4	1.32	1.14	2.092
121BM	H5	2.173	2.963	2.959		121BM	H5	1.403	1.147	2.162
121BM	H6	2.04	3.073	2.98		121BM	H6	1.359	1.148	1.991
121BM	H7	2.081	2.96	3.109		121BM	H7	1.266	1.234	2.109
121BM	H8	1.943	2.49	3.008		121BM	H8	0.95	0.894	1.847
121BM	H9	2.077	2.47	2.898		121BM	H9	0.864	0.96	1.969
121BM	C5	1.886	2.407	2.819		121BM	C5	0.864	0.743	1.979
121BM	H10	1.914	2.411	2.714		121BM	H10	0.796	0.749	2.064
121BM	H11	1.898	2.304	2.851		121BM	H11	0.805	0.718	1.891
121BM	H12	1.78	2.432	2.827		121BM	H12	0.939	0.667	2.001
122BM	C1	1.916	2.305	2.036		122BM	C1	2.107	2.309	2.979
122BM	H1	1.897	2.326	2.141		122BM	H1	2.039	2.366	2.915
122BM	H2	1.983	2.218	2.033		122BM	H2	2.164	2.256	2.903
122BM	C2	1.983	2.423	1.968		122BM	C2	2.026	2.216	3.073
122BM	H3	2.024	2.39	1.872		122BM	H3	2.088	2.189	3.159
122BM	H4	1.909	2.499	1.946		122BM	H4	1.935	2.263	3.109
122BM	C3	2.094	2.483	2.055		122BM	C3	1.985	2.091	2.999
122BM	O1	1.795	2.278	1.969		122BM	O1	2.183	2.399	3.058
122BM	C4	1.728	2.169	2.03		122BM	C4	2.251	2.495	2.979
122BM	H5	1.701	2.191	2.133		122BM	H5	2.305	2.559	3.049
122BM	H6	1.636	2.146	1.976		122BM	H6	2.319	2.446	2.909
122BM	H7	1.791	2.08	2.027		122BM	H7	2.176	2.548	2.92
122BM	H8	2.159	2.405	2.093		122BM	H8	2.075	2.037	2.972
122BM	H9	2.05	2.531	2.143		122BM	H9	1.949	2.117	2.899
122BM	C5	2.178	2.582	1.977		122BM	C5	1.878	2.001	3.076
122BM	H10	2.115	2.659	1.935		122BM	H10	1.922	1.95	3.161
122BM	H11	2.251	2.63	2.041		122BM	H11	1.798	2.065	3.114
122BM	H12	2.232	2.533	1.896		122BM	H12	1.835	1.921	3.016
123BM	C1	2.405	0.513	2.296		123BM	C1	1.436	0.835	2.528
123BM	H1	2.377	0.495	2.4		123BM	H1	1.479	0.931	2.555
123BM	H2	2.476	0.435	2.267		123BM	H2	1.491	0.765	2.592
123BM	C2	2.471	0.651	2.28		123BM	C2	1.453	0.8	2.379
123BM	H3	2.505	0.662	2.177		123BM	H3	1.407	0.704	2.354
123BM	H4	2.396	0.728	2.296		123BM	H4	1.392	0.873	2.326
123BM	C3	2.588	0.673	2.377		123BM	C3	1.596	0.798	2.325
123BM	O1	2.29	0.511	2.214		123BM	O1	1.297	0.826	2.564
123BM	C4	2.234	0.382	2.199		123BM	C4	1.259	0.832	2.703
123BM	H5	2.208	0.338	2.296		123BM	H5	1.288	0.74	2.754
123BM	H6	2.144	0.388	2.139		123BM	H6	1.304	0.92	2.748
123BM	H7	2.304	0.315	2.148		123BM	H7	1.15	0.824	2.711
123BM	H8	2.667	0.599	2.357		123BM	H8	1.654	0.881	2.365
123BM	H9	2.555	0.655	2.479		123BM	H9	1.599	0.811	2.217
123BM	C5	2.648	0.814	2.367		123BM	C5	1.679	0.677	2.362
123BM	H10	2.574	0.89	2.392		123BM	H10	1.699	0.693	2.468
123BM	H11	2.731	0.825	2.437		123BM	H11	1.635	0.578	2.348
123BM	H12	2.686	0.835	2.267		123BM	H12	1.773	0.684	2.309
124BM	C1	1.395	0.725	2.426		124BM	C1	2.696	0.58	0.009
124BM	H1	1.292	0.706	2.393		124BM	H1	2.62	0.592	-0.068
124BM	H2	1.434	0.632	2.467		124BM	H2	2.772	0.655	-0.016
124BM	C2	1.396	0.837	2.53		124BM	C2	2.761	0.441	-0.009
124BM	H3	1.499	0.863	2.554		124BM	H3	2.835	0.422	0.069
124BM	H4	1.35	0.925	2.486		124BM	H4	2.681	0.369	0.008
124BM	C3	1.32	0.8	2.659		124BM	C3	2.857	0.417	-0.134
124BM	O1	1.475	0.769	2.317		124BM	O1	2.646	0.6	0.142
124BM	C4	1.469	0.683	2.205		124BM	C4	2.6	0.732	0.16
124BM	H5	1.367	0.679	2.165		124BM	H5	2.545	0.756	0.252
124BM	H6	1.534	0.722	2.126		124BM	H6	2.686	0.798	0.15
124BM	H7	1.503	0.583	2.23		124BM	H7	2.534	0.764	0.08
124BM	H8	1.364	0.711	2.705		124BM	H8	2.925	0.332	-0.131
124BM	H9	1.217	0.776	2.635		124BM	H9	2.913	0.508	-0.158
124BM	C5	1.321	0.915	2.761		124BM	C5	2.77	0.393	-0.255
124BM	H10	1.273	1.004	2.721		124BM	H10	2.753	0.287	-0.268
124BM	H11	1.266	0.888	2.852		124BM	H11	2.678	0.45	-0.241
124BM	H12	1.422	0.942	2.792		124BM	H12	2.822	0.41	-0.349
125BM	C1	0.414	0.934	2.357		125BM	C1	1.172	2.744	0.234
125BM	H1	0.38	0.884	2.266		125BM	H1	1.251	2.773	0.304
125BM	H2	0.501	0.994	2.33		125BM	H2	1.221	2.662	0.181
125BM	C2	0.455	0.83	2.461		125BM	C2	1.133	2.853	0.135
125BM	H3	0.496	0.882	2.548		125BM	H3	1.116	2.809	0.036
125BM	H4	0.367	0.776	2.494		125BM	H4	1.041	2.905	0.161
125BM	C3	0.558	0.732	2.402		125BM	C3	1.248	2.954	0.1
125BM	O1	0.311	1.018	2.406		125BM	O1	1.056	2.705	0.286
125BM	C4	0.275	1.115	2.309		125BM	C4	1.072	2.59	0.371
125BM	H5	0.227	1.068	2.223		125BM	H5	1.1	2.505	0.308
125BM	H6	0.206	1.187	2.352		125BM	H6	1.152	2.599	0.444
125BM	H7	0.363	1.169	2.272		125BM	H7	0.99	2.558	0.436
125BM	H8	0.647	0.787	2.371		125BM	H8	1.317	2.918	0.024
125BM	H9	0.517	0.688	2.312		125BM	H9	1.308	2.979	0.188
125BM	C5	0.599	0.619	2.497		125BM	C5	1.194	3.093	0.058
125BM	H10	0.512	0.565	2.534		125BM	H10	1.111	3.078	-0.011
125BM	H11	0.663	0.547	2.445		125BM	H11	1.149	3.147	0.141
125BM	H12	0.655	0.657	2.582		125BM	H12	1.265	3.167	0.022
126BM	C1	1.995	1.168	1.365		126BM	C1	0.42	1.53	1.042
126BM	H1	1.984	1.262	1.31		126BM	H1	0.418	1.633	1.007
126BM	H2	1.978	1.088	1.292		126BM	H2	0.428	1.462	0.957
126BM	C2	1.894	1.166	1.479		126BM	C2	0.295	1.5	1.11
126BM	H3	1.796	1.183	1.432		126BM	H3	0.209	1.529	1.05
126BM	H4	1.88	1.068	1.525		126BM	H4	0.279	1.396	1.138
126BM	C3	1.92	1.281	1.577		126BM	C3	0.273	1.597	1.225
126BM	O1	2.123	1.157	1.425		126BM	O1	0.522	1.512	1.141
126BM	C4	2.225	1.188	1.33		126BM	C4	0.56	1.376	1.19
126BM	H5	2.214	1.29	1.291		126BM	H5	0.518	1.35	1.287
126BM	H6	2.324	1.182	1.374		126BM	H6	0.53	1.295	1.123
126BM	H7	2.223	1.12	1.245		126BM	H7	0.667	1.361	1.2
126BM	H8	1.825	1.33	1.596		126BM	H8	0.281	1.702	1.196
126BM	H9	1.98	1.36	1.53		126BM	H9	0.358	1.592	1.293
126BM	C5	1.977	1.246	1.714		126BM	C5	0.141	1.58	1.305
126BM	H10	2.08	1.21	1.716		126BM	H10	0.061	1.581	1.232
126BM	H11	1.978	1.337	1.774		126BM	H11	0.13	1.481	1.349
126BM	H12	1.911	1.179	1.769		126BM	H12	0.124	1.656	1.381
127BM	C1	2.286	2.076	1.703		127BM	C1	1.57	1.741	0.22
127BM	H1	2.319	2.066	1.599		127BM	H1	1.587	1.733	0.113
127BM	H2	2.26	1.976	1.738		127BM	H2	1.641	1.803	0.276
127BM	C2	2.166	2.17	1.713		127BM	C2	1.571	1.596	0.269
127BM	H3	2.137	2.179	1.818		127BM	H3	1.486	1.544	0.224
127BM	H4	2.196	2.269	1.679		127BM	H4	1.668	1.55	0.253
127BM	C3	2.048	2.119	1.629		127BM	C3	1.556	1.591	0.419
127BM	O1	2.39	2.13	1.782		127BM	O1	1.452	1.804	0.254
127BM	C4	2.504	2.046	1.782		127BM	C4	1.451	1.941	0.205
127BM	H5	2.543	2.032	1.681		127BM	H5	1.46	1.927	0.097
127BM	H6	2.584	2.09	1.842		127BM	H6	1.356	1.994	0.22
127BM	H7	2.482	1.948	1.825		127BM	H7	1.535	2.001	0.239
127BM	H8	2.022	2.018	1.66		127BM	H8	1.462	1.636	0.453
127BM	H9	2.079	2.112	1.525		127BM	H9	1.642	1.653	0.446
127BM	C5	1.923	2.209	1.64		127BM	C5	1.561	1.445	0.478
127BM	H10	1.946	2.311	1.612		127BM	H10	1.542	1.454	0.585
127BM	H11	1.844	2.173	1.574		127BM	H11	1.484	1.382	0.434
127BM	H12	1.884	2.209	1.741		127BM	H12	1.657	1.396	0.463
128BM	C1	1.722	2.391	2.46		128BM	C1	1.74	0.152	0.011
128BM	H1	1.633	2.451	2.441		128BM	H1	1.828	0.191	-0.039
128BM	H2	1.731	2.377	2.568		128BM	H2	1.656	0.215	-0.02
128BM	C2	1.847	2.461	2.404		128BM	C2	1.767	0.134	0.164
128BM	H3	1.932	2.394	2.414		128BM	H3	1.845	0.063	0.188
128BM	H4	1.833	2.476	2.297		128BM	H4	1.805	0.231	0.198
128BM	C3	1.877	2.595	2.473		128BM	C3	1.637	0.098	0.237
128BM	O1	1.711	2.265	2.396		128BM	O1	1.71	0.018	-0.03
128BM	C4	1.603	2.188	2.447		128BM	C4	1.706	0.002	-0.17
128BM	H5	1.509	2.242	2.443		128BM	H5	1.624	0.055	-0.218
128BM	H6	1.591	2.097	2.387		128BM	H6	1.803	0.046	-0.195
128BM	H7	1.622	2.157	2.55		128BM	H7	1.712	-0.104	-0.195
128BM	H8	1.869	2.584	2.581		128BM	H8	1.608	-0.007	0.236
128BM	H9	1.801	2.668	2.445		128BM	H9	1.547	0.151	0.204
128BM	C5	2.016	2.65	2.439		128BM	C5	1.648	0.124	0.384
128BM	H10	2.027	2.671	2.333		128BM	H10	1.654	0.226	0.42
128BM	H11	2.036	2.743	2.493		128BM	H11	1.564	0.074	0.434
128BM	H12	2.094	2.579	2.466		128BM	H12	1.747	0.083	0.404
129BM	C1	0.163	1.359	0.851		129BM	C1	2.888	1.144	0.267
129BM	H1	0.253	1.36	0.79		129BM	H1	2.876	1.232	0.331
129BM	H2	0.081	1.396	0.789		129BM	H2	2.967	1.078	0.302
129BM	C2	0.185	1.451	0.971		129BM	C2	2.891	1.176	0.117
129BM	H3	0.107	1.435	1.046		129BM	H3	2.793	1.221	0.096
129BM	H4	0.277	1.424	1.022		129BM	H4	2.962	1.255	0.093
129BM	C3	0.19	1.599	0.93		129BM	C3	2.916	1.048	0.027
129BM	O1	0.134	1.227	0.893		129BM	O1	2.78	1.052	0.278
129BM	C4	0.137	1.133	0.786		129BM	C4	2.75	0.999	0.411
129BM	H5	0.237	1.124	0.745		129BM	H5	2.833	1.008	0.482
129BM	H6	0.107	1.035	0.821		129BM	H6	2.682	1.075	0.449
129BM	H7	0.072	1.162	0.704		129BM	H7	2.705	0.9	0.423
129BM	H8	0.105	1.624	0.868		129BM	H8	2.83	0.982	0.035
129BM	H9	0.279	1.618	0.869		129BM	H9	3.001	0.984	0.051
129BM	C5	0.193	1.694	1.051		129BM	C5	2.934	1.09	-0.121
129BM	H10	0.285	1.679	1.109		129BM	H10	2.842	1.121	-0.171
129BM	H11	0.192	1.798	1.019		129BM	H11	3.012	1.166	-0.133
129BM	H12	0.108	1.678	1.118		129BM	H12	2.971	0.995	-0.159
130BM	C1	1.356	0.095	0.57		130BM	C1	0.584	0.602	0.215
130BM	H1	1.463	0.115	0.579		130BM	H1	0.526	0.523	0.264
130BM	H2	1.341	0.001	0.622		130BM	H2	0.641	0.546	0.142
130BM	C2	1.314	0.08	0.424		130BM	C2	0.684	0.682	0.307
130BM	H3	1.362	-0.01	0.383		130BM	H3	0.741	0.753	0.247
130BM	H4	1.207	0.059	0.419		130BM	H4	0.634	0.744	0.381
130BM	C3	1.35	0.199	0.333		130BM	C3	0.785	0.586	0.381
130BM	O1	1.278	0.2	0.625		130BM	O1	0.499	0.695	0.147
130BM	C4	1.201	0.159	0.738		130BM	C4	0.375	0.718	0.219
130BM	H5	1.264	0.127	0.821		130BM	H5	0.385	0.759	0.32
130BM	H6	1.139	0.241	0.774		130BM	H6	0.309	0.795	0.18
130BM	H7	1.134	0.076	0.714		130BM	H7	0.318	0.625	0.219
130BM	H8	1.457	0.212	0.333		130BM	H8	0.885	0.629	0.388
130BM	H9	1.303	0.291	0.367		130BM	H9	0.81	0.503	0.315
130BM	C5	1.305	0.176	0.188		130BM	C5	0.719	0.53	0.512
130BM	H10	1.197	0.172	0.18		130BM	H10	0.797	0.519	0.588
130BM	H11	1.341	0.256	0.124		130BM	H11	0.638	0.594	0.547
130BM	H12	1.346	0.082	0.149		130BM	H12	0.671	0.434	0.496
131BM	C1	1.245	1.45	2.203		131BM	C1	2.626	2.306	0.599
131BM	H1	1.235	1.359	2.262		131BM	H1	2.659	2.259	0.692
131BM	H2	1.244	1.419	2.098		131BM	H2	2.637	2.411	0.623
131BM	C2	1.377	1.52	2.233		131BM	C2	2.483	2.269	0.554
131BM	H3	1.383	1.612	2.175		131BM	H3	2.477	2.337	0.469
131BM	H4	1.38	1.548	2.338		131BM	H4	2.48	2.17	0.509
131BM	C3	1.496	1.428	2.199		131BM	C3	2.372	2.31	0.658
131BM	O1	1.136	1.536	2.229		131BM	O1	2.721	2.298	0.492
131BM	C4	1.015	1.479	2.18		131BM	C4	2.859	2.313	0.53
131BM	H5	0.999	1.38	2.221		131BM	H5	2.925	2.298	0.445
131BM	H6	0.929	1.54	2.206		131BM	H6	2.879	2.412	0.573
131BM	H7	1.016	1.47	2.071		131BM	H7	2.889	2.234	0.599
131BM	H8	1.489	1.396	2.095		131BM	H8	2.411	2.391	0.719
131BM	H9	1.489	1.337	2.259		131BM	H9	2.35	2.229	0.728
131BM	C5	1.633	1.492	2.221		131BM	C5	2.235	2.34	0.595
131BM	H10	1.643	1.535	2.321		131BM	H10	2.158	2.386	0.657
131BM	H11	1.712	1.418	2.208		131BM	H11	2.244	2.402	0.507
131BM	H12	1.649	1.57	2.147		131BM	H12	2.189	2.249	0.555
132BM	C1	2.065	1.65	1.648		132BM	C1	1.356	1.147	0.799
132BM	H1	2.031	1.591	1.563		132BM	H1	1.27	1.083	0.821
132BM	H2	2.024	1.75	1.638		132BM	H2	1.311	1.244	0.781
132BM	C2	2.218	1.658	1.65		132BM	C2	1.439	1.106	0.676
132BM	H3	2.249	1.714	1.738		132BM	H3	1.514	1.181	0.65
132BM	H4	2.26	1.558	1.66		132BM	H4	1.503	1.021	0.701
132BM	C3	2.275	1.727	1.525		132BM	C3	1.352	1.078	0.556
132BM	O1	2.023	1.59	1.77		132BM	O1	1.441	1.157	0.909
132BM	C4	1.883	1.603	1.79		132BM	C4	1.392	1.224	1.026
132BM	H5	1.826	1.555	1.711		132BM	H5	1.465	1.217	1.106
132BM	H6	1.853	1.557	1.884		132BM	H6	1.369	1.327	0.999
132BM	H7	1.852	1.708	1.794		132BM	H7	1.295	1.18	1.052
132BM	H8	2.228	1.824	1.513		132BM	H8	1.3	1.172	0.538
132BM	H9	2.25	1.67	1.435		132BM	H9	1.279	1.004	0.587
132BM	C5	2.426	1.746	1.534		132BM	C5	1.425	1.038	0.424
132BM	H10	2.479	1.651	1.532		132BM	H10	1.505	1.107	0.398
132BM	H11	2.463	1.806	1.451		132BM	H11	1.465	0.938	0.408
132BM	H12	2.454	1.799	1.626		132BM	H12	1.353	1.047	0.343
133BM	C1	1.348	0.761	0.495		133BM	C1	0.492	0.21	0.859
133BM	H1	1.425	0.693	0.53		133BM	H1	0.388	0.216	0.893
133BM	H2	1.287	0.789	0.58		133BM	H2	0.499	0.223	0.751
133BM	C2	1.264	0.691	0.388		133BM	C2	0.567	0.09	0.907
133BM	H3	1.184	0.758	0.356		133BM	H3	0.67	0.106	0.876
133BM	H4	1.326	0.673	0.3		133BM	H4	0.573	0.076	1.015
133BM	C3	1.2	0.562	0.438		133BM	C3	0.525	-0.045	0.855
133BM	O1	1.412	0.872	0.436		133BM	O1	0.55	0.323	0.924
133BM	C4	1.485	0.947	0.531		133BM	C4	0.49	0.449	0.892
133BM	H5	1.556	0.885	0.586		133BM	H5	0.515	0.476	0.79
133BM	H6	1.543	1.025	0.481		133BM	H6	0.382	0.433	0.901
133BM	H7	1.419	0.996	0.603		133BM	H7	0.524	0.541	0.939
133BM	H8	1.128	0.585	0.516		133BM	H8	0.559	-0.056	0.752
133BM	H9	1.276	0.498	0.483		133BM	H9	0.416	-0.051	0.857
133BM	C5	1.13	0.489	0.323		133BM	C5	0.569	-0.162	0.937
133BM	H10	1.2	0.461	0.243		133BM	H10	0.675	-0.179	0.954
133BM	H11	1.079	0.398	0.356		133BM	H11	0.522	-0.166	1.035
133BM	H12	1.056	0.555	0.278		133BM	H12	0.534	-0.252	0.886
134BM	C1	0.01	1.186	1.342		134BM	C1	0.227	1.791	1.745
134BM	H1	0.099	1.231	1.296		134BM	H1	0.207	1.703	1.684
134BM	H2	-0.067	1.262	1.339		134BM	H2	0.14	1.795	1.81
134BM	C2	0.046	1.147	1.486		134BM	C2	0.232	1.914	1.651
134BM	H3	-0.038	1.101	1.536		134BM	H3	0.131	1.922	1.612
134BM	H4	0.126	1.074	1.485		134BM	H4	0.25	1.997	1.719
134BM	C3	0.093	1.267	1.568		134BM	C3	0.33	1.9	1.537
134BM	O1	-0.033	1.069	1.273		134BM	O1	0.351	1.789	1.818
134BM	C4	0.008	1.073	1.137		134BM	C4	0.383	1.659	1.871
134BM	H5	0.116	1.082	1.127		134BM	H5	0.401	1.585	1.794
134BM	H6	-0.02	0.982	1.083		134BM	H6	0.471	1.651	1.934
134BM	H7	-0.037	1.157	1.084		134BM	H7	0.299	1.627	1.933
134BM	H8	0.024	1.351	1.558		134BM	H8	0.332	1.796	1.504
134BM	H9	0.188	1.301	1.528		134BM	H9	0.431	1.919	1.572
134BM	C5	0.111	1.233	1.716		134BM	C5	0.292	1.992	1.419
134BM	H10	0.182	1.152	1.73		134BM	H10	0.257	2.089	1.455
134BM	H11	0.151	1.32	1.77		134BM	H11	0.378	2.005	1.353
134BM	H12	0.017	1.205	1.763		134BM	H12	0.211	1.951	1.36
135BM	C1	0.051	0.423	0.356		135BM	C1	0.035	0.637	1.791
135BM	H1	0.148	0.423	0.306		135BM	H1	-0.003	0.539	1.821
135BM	H2	-0.02	0.472	0.288		135BM	H2	0.14	0.621	1.817
135BM	C2	0.059	0.505	0.485		135BM	C2	-0.027	0.753	1.854
135BM	H3	-0.039	0.507	0.533		135BM	H3	-0.13	0.773	1.826
135BM	H4	0.127	0.457	0.556		135BM	H4	-0.029	0.731	1.961
135BM	C3	0.106	0.65	0.46		135BM	C3	0.059	0.879	1.843
135BM	O1	0.01	0.29	0.383		135BM	O1	0.031	0.642	1.653
135BM	C4	-0.015	0.217	0.263		135BM	C4	0.08	0.526	1.595
135BM	H5	0.074	0.213	0.2		135BM	H5	0.095	0.532	1.487
135BM	H6	-0.047	0.115	0.283		135BM	H6	0.178	0.504	1.635
135BM	H7	-0.095	0.264	0.205		135BM	H7	0.014	0.44	1.607
135BM	H8	0.04	0.698	0.388		135BM	H8	0.053	0.9	1.736
135BM	H9	0.205	0.648	0.414		135BM	H9	0.157	0.86	1.887
135BM	C5	0.113	0.734	0.587		135BM	C5	-0.001	0.999	1.913
135BM	H10	0.183	0.692	0.66		135BM	H10	0.07	1.081	1.918
135BM	H11	0.148	0.836	0.565		135BM	H11	-0.088	1.031	1.855
135BM	H12	0.016	0.743	0.636		135BM	H12	-0.045	0.97	2.008
136BM	C1	2.468	0.472	0.805		136BM	C1	1.206	1.689	2.598
136BM	H1	2.453	0.426	0.708		136BM	H1	1.106	1.719	2.565
136BM	H2	2.392	0.55	0.816		136BM	H2	1.224	1.765	2.674
136BM	C2	2.607	0.534	0.813		136BM	C2	1.308	1.695	2.478
136BM	H3	2.618	0.584	0.909		136BM	H3	1.399	1.653	2.52
136BM	H4	2.682	0.455	0.811		136BM	H4	1.287	1.64	2.386
136BM	C3	2.633	0.633	0.699		136BM	C3	1.328	1.841	2.435
136BM	O1	2.452	0.376	0.909		136BM	O1	1.219	1.556	2.658
136BM	C4	2.327	0.311	0.902		136BM	C4	1.136	1.537	2.776
136BM	H5	2.313	0.262	0.805		136BM	H5	1.173	1.601	2.856
136BM	H6	2.32	0.235	0.979		136BM	H6	1.032	1.557	2.75
136BM	H7	2.245	0.382	0.916		136BM	H7	1.146	1.431	2.802
136BM	H8	2.559	0.713	0.704		136BM	H8	1.348	1.898	2.526
136BM	H9	2.618	0.583	0.603		136BM	H9	1.232	1.875	2.396
136BM	C5	2.773	0.696	0.702		136BM	C5	1.44	1.843	2.321
136BM	H10	2.851	0.62	0.698		136BM	H10	1.44	1.935	2.262
136BM	H11	2.787	0.763	0.617		136BM	H11	1.534	1.849	2.376
136BM	H12	2.788	0.754	0.793		136BM	H12	1.428	1.758	2.254
137BM	C1	2.26	1.447	2.418		137BM	C1	0.027	1.481	2.354
137BM	H1	2.215	1.373	2.485		137BM	H1	-0.066	1.468	2.299
137BM	H2	2.216	1.434	2.319		137BM	H2	0.1	1.505	2.276
137BM	C2	2.411	1.425	2.412		137BM	C2	0.06	1.345	2.418
137BM	H3	2.455	1.495	2.34		137BM	H3	0.154	1.35	2.474
137BM	H4	2.455	1.449	2.508		137BM	H4	-0.01	1.311	2.495
137BM	C3	2.445	1.28	2.373		137BM	C3	0.068	1.243	2.304
137BM	O1	2.231	1.576	2.467		137BM	O1	0.015	1.582	2.452
137BM	C4	2.091	1.602	2.469		137BM	C4	-0.097	1.568	2.548
137BM	H5	2.038	1.527	2.528		137BM	H5	-0.083	1.476	2.605
137BM	H6	2.073	1.699	2.514		137BM	H6	-0.103	1.656	2.612
137BM	H7	2.05	1.603	2.368		137BM	H7	-0.198	1.568	2.507
137BM	H8	2.398	1.255	2.278		137BM	H8	0.157	1.257	2.243
137BM	H9	2.402	1.212	2.448		137BM	H9	-0.017	1.256	2.237
137BM	C5	2.596	1.254	2.364		137BM	C5	0.074	1.103	2.36
137BM	H10	2.647	1.277	2.457		137BM	H10	0.098	1.021	2.292
137BM	H11	2.616	1.15	2.341		137BM	H11	0.146	1.096	2.442
137BM	H12	2.641	1.314	2.285		137BM	H12	-0.021	1.078	2.407
138BM	C1	1.267	0.65	3.038		138BM	C1	1.065	0.993	0.093
138BM	H1	1.321	0.646	2.944		138BM	H1	1.163	0.99	0.045
138BM	H2	1.297	0.565	3.098		138BM	H2	0.991	0.972	0.015
138BM	C2	1.116	0.651	3.013		138BM	C2	1.047	1.136	0.141
138BM	H3	1.063	0.668	3.107		138BM	H3	0.943	1.155	0.168
138BM	H4	1.092	0.736	2.949		138BM	H4	1.094	1.125	0.239
138BM	C3	1.066	0.521	2.948		138BM	C3	1.105	1.26	0.059
138BM	O1	1.297	0.77	3.107		138BM	O1	1.053	0.913	0.207
138BM	C4	1.435	0.796	3.117		138BM	C4	1.055	0.775	0.165
138BM	H5	1.479	0.812	3.019		138BM	H5	1.066	0.709	0.251
138BM	H6	1.452	0.886	3.176		138BM	H6	0.959	0.752	0.117
138BM	H7	1.489	0.714	3.166		138BM	H7	1.142	0.754	0.103
138BM	H8	1.078	0.438	3.018		138BM	H8	1.071	1.268	-0.044
138BM	H9	1.128	0.498	2.861		138BM	H9	1.214	1.269	0.07
138BM	C5	0.92	0.53	2.902		138BM	C5	1.056	1.391	0.132
138BM	H10	0.907	0.605	2.824		138BM	H10	1.065	1.389	0.241
138BM	H11	0.887	0.434	2.862		138BM	H11	1.095	1.481	0.084
138BM	H12	0.854	0.556	2.984		138BM	H12	0.951	1.407	0.108
139BM	C1	0.916	2.227	1.643		139BM	C1	2.474	2.628	2.478
139BM	H1	0.865	2.28	1.563		139BM	H1	2.505	2.525	2.459
139BM	H2	0.84	2.178	1.704		139BM	H2	2.532	2.693	2.413
139BM	C2	0.997	2.325	1.728		139BM	C2	2.486	2.654	2.624
139BM	H3	1.052	2.27	1.804		139BM	H3	2.442	2.571	2.68
139BM	H4	1.071	2.373	1.664		139BM	H4	2.59	2.641	2.651
139BM	C3	0.91	2.432	1.794		139BM	C3	2.422	2.794	2.655
139BM	O1	1.006	2.131	1.59		139BM	O1	2.344	2.627	2.439
139BM	C4	0.94	2.034	1.51		139BM	C4	2.326	2.583	2.304
139BM	H5	0.895	2.08	1.422		139BM	H5	2.368	2.483	2.296
139BM	H6	1.01	1.959	1.475		139BM	H6	2.222	2.594	2.275
139BM	H7	0.861	1.982	1.566		139BM	H7	2.379	2.659	2.245
139BM	H8	0.837	2.384	1.86		139BM	H8	2.318	2.784	2.624
139BM	H9	0.85	2.482	1.718		139BM	H9	2.468	2.867	2.589
139BM	C5	0.991	2.537	1.871		139BM	C5	2.44	2.833	2.803
139BM	H10	1.063	2.587	1.806		139BM	H10	2.418	2.754	2.875
139BM	H11	0.926	2.614	1.911		139BM	H11	2.542	2.868	2.813
139BM	H12	1.045	2.492	1.954		139BM	H12	2.374	2.916	2.828
140BM	C1	2.41	2.719	2.27		140BM	C1	1.182	0.021	0.57
140BM	H1	2.308	2.722	2.232		140BM	H1	1.207	-0.007	0.468
140BM	H2	2.402	2.688	2.375		140BM	H2	1.274	0.02	0.628
140BM	C2	2.474	2.859	2.265		140BM	C2	1.08	-0.072	0.625
140BM	H3	2.563	2.86	2.327		140BM	H3	1.134	-0.163	0.651
140BM	H4	2.506	2.883	2.164		140BM	H4	1.057	-0.03	0.723
140BM	C3	2.379	2.968	2.316		140BM	C3	0.956	-0.086	0.538
140BM	O1	2.488	2.626	2.195		140BM	O1	1.131	0.148	0.559
140BM	C4	2.459	2.492	2.234		140BM	C4	1.221	0.241	0.492
140BM	H5	2.355	2.466	2.215		140BM	H5	1.198	0.253	0.387
140BM	H6	2.521	2.42	2.181		140BM	H6	1.198	0.339	0.533
140BM	H7	2.48	2.476	2.34		140BM	H7	1.329	0.227	0.486
140BM	H8	2.347	2.946	2.418		140BM	H8	0.99	-0.14	0.45
140BM	H9	2.288	2.97	2.255		140BM	H9	0.914	0.012	0.514
140BM	C5	2.444	3.107	2.312		140BM	C5	0.848	-0.179	0.611
140BM	H10	2.475	3.134	2.21		140BM	H10	0.801	-0.126	0.694
140BM	H11	2.376	3.184	2.347		140BM	H11	0.767	-0.208	0.545
140BM	H12	2.533	3.111	2.375		140BM	H12	0.888	-0.275	0.643
141BM	C1	1.564	2.761	0.521		141BM	C1	3.025	2.846	0.382
141BM	H1	1.543	2.821	0.433		141BM	H1	2.938	2.803	0.332
141BM	H2	1.494	2.789	0.6		141BM	H2	2.983	2.894	0.47
141BM	C2	1.708	2.78	0.568		141BM	C2	3.1	2.938	0.283
141BM	H3	1.723	2.718	0.657		141BM	H3	3.189	2.977	0.332
141BM	H4	1.774	2.741	0.49		141BM	H4	3.141	2.867	0.211
141BM	C3	1.748	2.923	0.601		141BM	C3	3.023	3.053	0.212
141BM	O1	1.553	2.623	0.492		141BM	O1	3.116	2.75	0.421
141BM	C4	1.422	2.586	0.453		141BM	C4	3.082	2.642	0.504
141BM	H5	1.388	2.645	0.367		141BM	H5	3.164	2.616	0.571
141BM	H6	1.418	2.481	0.425		141BM	H6	3.002	2.665	0.574
141BM	H7	1.352	2.601	0.535		141BM	H7	3.061	2.546	0.457
141BM	H8	1.689	2.96	0.685		141BM	H8	2.996	3.13	0.284
141BM	H9	1.728	2.988	0.516		141BM	H9	2.932	3.018	0.164
141BM	C5	1.898	2.928	0.636		141BM	C5	3.101	3.113	0.1
141BM	H10	1.958	2.897	0.551		141BM	H10	3.197	3.143	0.143
141BM	H11	1.93	3.028	0.664		141BM	H11	3.11	3.05	0.012
141BM	H12	1.921	2.862	0.719		141BM	H12	3.049	3.207	0.078
142BM	C1	0.813	1.736	2.4		142BM	C1	2.431	1.627	0.849
142BM	H1	0.799	1.636	2.443		142BM	H1	2.331	1.636	0.808
142BM	H2	0.889	1.727	2.323		142BM	H2	2.412	1.633	0.956
142BM	C2	0.86	1.829	2.511		142BM	C2	2.533	1.738	0.828
142BM	H3	0.87	1.93	2.471		142BM	H3	2.61	1.735	0.906
142BM	H4	0.784	1.832	2.588		142BM	H4	2.585	1.715	0.735
142BM	C3	0.994	1.781	2.571		142BM	C3	2.461	1.874	0.818
142BM	O1	0.69	1.781	2.343		142BM	O1	2.505	1.509	0.81
142BM	C4	0.642	1.684	2.251		142BM	C4	2.431	1.387	0.814
142BM	H5	0.624	1.587	2.299		142BM	H5	2.397	1.368	0.712
142BM	H6	0.549	1.714	2.204		142BM	H6	2.502	1.306	0.827
142BM	H7	0.714	1.667	2.17		142BM	H7	2.364	1.385	0.9
142BM	H8	1.074	1.794	2.499		142BM	H8	2.423	1.888	0.919
142BM	H9	0.986	1.673	2.588		142BM	H9	2.382	1.881	0.744
142BM	C5	1.03	1.847	2.705		142BM	C5	2.569	1.986	0.789
142BM	H10	0.95	1.835	2.777		142BM	H10	2.519	2.081	0.771
142BM	H11	1.119	1.798	2.747		142BM	H11	2.637	1.997	0.873
142BM	H12	1.055	1.952	2.695		142BM	H12	2.635	1.958	0.707
143BM	C1	1.874	1.2	2.443		143BM	C1	0.846	1.831	2.711
143BM	H1	1.911	1.235	2.539		143BM	H1	0.875	1.741	2.656
143BM	H2	1.871	1.286	2.376		143BM	H2	0.801	1.895	2.634
143BM	C2	1.735	1.139	2.46		143BM	C2	0.974	1.889	2.777
143BM	H3	1.701	1.1	2.364		143BM	H3	1.02	1.819	2.847
143BM	H4	1.74	1.053	2.527		143BM	H4	1.048	1.908	2.699
143BM	C3	1.632	1.24	2.513		143BM	C3	0.947	2.022	2.849
143BM	O1	1.958	1.099	2.389		143BM	O1	0.764	1.799	2.816
143BM	C4	2.095	1.134	2.39		143BM	C4	0.641	1.735	2.774
143BM	H5	2.132	1.151	2.491		143BM	H5	0.587	1.802	2.708
143BM	H6	2.153	1.052	2.348		143BM	H6	0.661	1.639	2.725
143BM	H7	2.114	1.222	2.33		143BM	H7	0.579	1.721	2.863
143BM	H8	1.632	1.328	2.449		143BM	H8	0.893	2.009	2.942
143BM	H9	1.66	1.274	2.612		143BM	H9	0.891	2.089	2.783
143BM	C5	1.491	1.182	2.516		143BM	C5	1.079	2.099	2.889
143BM	H10	1.481	1.106	2.593		143BM	H10	1.155	2.045	2.944
143BM	H11	1.417	1.259	2.536		143BM	H11	1.125	2.124	2.793
143BM	H12	1.464	1.137	2.42		143BM	H12	1.055	2.186	2.95
144BM	C1	1.797	0.786	1.013		144BM	C1	2.22	1.64	2.104
144BM	H1	1.76	0.888	1.011		144BM	H1	2.155	1.722	2.133
144BM	H2	1.722	0.724	1.064		144BM	H2	2.161	1.598	2.022
144BM	C2	1.931	0.783	1.087		144BM	C2	2.251	1.536	2.219
144BM	H3	1.978	0.686	1.069		144BM	H3	2.339	1.48	2.19
144BM	H4	1.997	0.857	1.043		144BM	H4	2.284	1.587	2.31
144BM	C3	1.913	0.807	1.237		144BM	C3	2.131	1.447	2.248
144BM	O1	1.816	0.736	0.883		144BM	O1	2.342	1.673	2.056
144BM	C4	1.706	0.761	0.798		144BM	C4	2.408	1.773	2.133
144BM	H5	1.701	0.867	0.774		144BM	H5	2.338	1.853	2.157
144BM	H6	1.717	0.709	0.704		144BM	H6	2.438	1.742	2.234
144BM	H7	1.612	0.728	0.842		144BM	H7	2.493	1.811	2.077
144BM	H8	1.846	0.731	1.278		144BM	H8	2.106	1.374	2.171
144BM	H9	1.861	0.902	1.252		144BM	H9	2.035	1.498	2.254
144BM	C5	2.045	0.804	1.313		144BM	C5	2.159	1.361	2.376
144BM	H10	2.114	0.88	1.275		144BM	H10	2.141	1.413	2.47
144BM	H11	2.028	0.821	1.419		144BM	H11	2.091	1.276	2.37
144BM	H12	2.095	0.707	1.303		144BM	H12	2.259	1.318	2.376
145BM	C1	1.531	2.073	1.488		145BM	C1	1.609	2.143	1.956
145BM	H1	1.575	2.165	1.45		145BM	H1	1.626	2.246	1.987
145BM	H2	1.613	2.003	1.506		145BM	H2	1.632	2.134	1.85
145BM	C2	1.431	2.016	1.386		145BM	C2	1.46	2.1	1.992
145BM	H3	1.397	1.918	1.42		145BM	H3	1.44	1.994	1.975
145BM	H4	1.342	2.078	1.388		145BM	H4	1.463	2.118	2.099
145BM	C3	1.489	2.007	1.244		145BM	C3	1.359	2.195	1.929
145BM	O1	1.463	2.098	1.608		145BM	O1	1.7	2.06	2.029
145BM	C4	1.545	2.16	1.706		145BM	C4	1.829	2.093	1.996
145BM	H5	1.583	2.256	1.672		145BM	H5	1.856	2.197	2.015
145BM	H6	1.486	2.177	1.796		145BM	H6	1.897	2.033	2.055
145BM	H7	1.629	2.096	1.733		145BM	H7	1.836	2.079	1.888
145BM	H8	1.563	1.928	1.239		145BM	H8	1.332	2.17	1.826
145BM	H9	1.541	2.099	1.219		145BM	H9	1.397	2.297	1.93
145BM	C5	1.382	1.98	1.137		145BM	C5	1.226	2.183	2.011
145BM	H10	1.32	2.067	1.122		145BM	H10	1.206	2.083	2.049
145BM	H11	1.428	1.956	1.04		145BM	H11	1.222	2.25	2.097
145BM	H12	1.317	1.897	1.164		145BM	H12	1.143	2.217	1.95
146BM	C1	0.258	1.854	0.149		146BM	C1	0.394	0.317	1.219
146BM	H1	0.313	1.835	0.057		146BM	H1	0.491	0.269	1.203
146BM	H2	0.33	1.856	0.231		146BM	H2	0.379	0.386	1.136
146BM	C2	0.155	1.743	0.174		146BM	C2	0.401	0.389	1.35
146BM	H3	0.107	1.761	0.27		146BM	H3	0.31	0.441	1.381
146BM	H4	0.077	1.751	0.099		146BM	H4	0.414	0.315	1.43
146BM	C3	0.218	1.603	0.173		146BM	C3	0.51	0.496	1.37
146BM	O1	0.19	1.978	0.14		146BM	O1	0.29	0.218	1.219
146BM	C4	0.28	2.086	0.12		146BM	C4	0.165	0.278	1.191
146BM	H5	0.339	2.073	0.029		146BM	H5	0.168	0.347	1.106
146BM	H6	0.225	2.179	0.111		146BM	H6	0.095	0.197	1.175
146BM	H7	0.348	2.096	0.205		146BM	H7	0.129	0.325	1.283
146BM	H8	0.288	1.594	0.256		146BM	H8	0.605	0.446	1.351
146BM	H9	0.281	1.591	0.084		146BM	H9	0.52	0.539	1.47
146BM	C5	0.114	1.49	0.177		146BM	C5	0.508	0.603	1.261
146BM	H10	0.04	1.499	0.098		146BM	H10	0.41	0.652	1.252
146BM	H11	0.163	1.394	0.166		146BM	H11	0.586	0.679	1.265
146BM	H12	0.06	1.49	0.272		146BM	H12	0.547	0.555	1.171
147BM	C1	1.096	0.509	2.081		147BM	C1	2.109	1.576	0.518
147BM	H1	1.113	0.563	2.174		147BM	H1	2.185	1.516	0.569
147BM	H2	1.131	0.571	1.999		147BM	H2	2.063	1.519	0.438
147BM	C2	0.946	0.479	2.065		147BM	C2	2.162	1.695	0.446
147BM	H3	0.933	0.403	1.989		147BM	H3	2.223	1.656	0.365
147BM	H4	0.907	0.436	2.157		147BM	H4	2.068	1.733	0.406
147BM	C3	0.866	0.604	2.028		147BM	C3	2.246	1.791	0.534
147BM	O1	1.164	0.385	2.08		147BM	O1	2.005	1.616	0.599
147BM	C4	1.302	0.398	2.105		147BM	C4	1.936	1.511	0.658
147BM	H5	1.319	0.434	2.206		147BM	H5	2.007	1.464	0.727
147BM	H6	1.349	0.3	2.096		147BM	H6	1.854	1.548	0.719
147BM	H7	1.35	0.465	2.033		147BM	H7	1.893	1.445	0.583
147BM	H8	0.915	0.658	1.947		147BM	H8	2.322	1.733	0.585
147BM	H9	0.862	0.674	2.112		147BM	H9	2.183	1.84	0.608
147BM	C5	0.723	0.571	1.984		147BM	C5	2.323	1.896	0.459
147BM	H10	0.664	0.531	2.066		147BM	H10	2.245	1.951	0.406
147BM	H11	0.672	0.659	1.946		147BM	H11	2.381	1.966	0.519
147BM	H12	0.723	0.497	1.903		147BM	H12	2.398	1.854	0.391
148BM	C1	2.148	0.91	2.672		148BM	C1	0.783	0.13	2.035
148BM	H1	2.182	0.83	2.739		148BM	H1	0.824	0.068	1.955
148BM	H2	2.235	0.971	2.648		148BM	H2	0.687	0.087	2.063
148BM	C2	2.042	0.996	2.741		148BM	C2	0.765	0.278	2.002
148BM	H3	2.009	1.074	2.673		148BM	H3	0.712	0.327	2.083
148BM	H4	1.954	0.935	2.762		148BM	H4	0.862	0.328	2.001
148BM	C3	2.095	1.059	2.87		148BM	C3	0.709	0.283	1.863
148BM	O1	2.091	0.855	2.555		148BM	O1	0.874	0.114	2.139
148BM	C4	2.184	0.786	2.473		148BM	C4	0.857	-0.011	2.201
148BM	H5	2.211	0.69	2.517		148BM	H5	0.853	-0.095	2.132
148BM	H6	2.14	0.766	2.376		148BM	H6	0.944	-0.033	2.263
148BM	H7	2.274	0.844	2.456		148BM	H7	0.767	-0.021	2.26
148BM	H8	2.183	1.12	2.848		148BM	H8	0.627	0.211	1.859
148BM	H9	2.13	0.98	2.936		148BM	H9	0.78	0.263	1.782
148BM	C5	1.99	1.144	2.943		148BM	C5	0.648	0.415	1.844
148BM	H10	1.903	1.084	2.97		148BM	H10	0.562	0.423	1.911
148BM	H11	2.031	1.185	3.036		148BM	H11	0.712	0.502	1.857
148BM	H12	1.957	1.227	2.882		148BM	H12	0.613	0.431	1.742
149BM	C1	0.337	2.149	0.525		149BM	C1	1.934	2.665	0.345
149BM	H1	0.405	2.109	0.449		149BM	H1	1.963	2.56	0.339
149BM	H2	0.395	2.162	0.617		149BM	H2	2.018	2.722	0.305
149BM	C2	0.222	2.05	0.548		149BM	C2	1.897	2.706	0.489
149BM	H3	0.153	2.091	0.622		149BM	H3	1.861	2.809	0.493
149BM	H4	0.166	2.04	0.455		149BM	H4	1.817	2.636	0.512
149BM	C3	0.271	1.912	0.593		149BM	C3	2.011	2.693	0.592
149BM	O1	0.284	2.274	0.484		149BM	O1	1.817	2.688	0.272
149BM	C4	0.385	2.364	0.442		149BM	C4	1.816	2.817	0.209
149BM	H5	0.441	2.324	0.358		149BM	H5	1.72	2.82	0.159
149BM	H6	0.341	2.458	0.411		149BM	H6	1.82	2.904	0.274
149BM	H7	0.456	2.385	0.523		149BM	H7	1.899	2.828	0.138
149BM	H8	0.326	1.922	0.687		149BM	H8	2.09	2.76	0.561
149BM	H9	0.342	1.872	0.521		149BM	H9	2.059	2.596	0.586
149BM	C5	0.157	1.812	0.612		149BM	C5	1.95	2.734	0.735
149BM	H10	0.1	1.798	0.52		149BM	H10	1.998	2.82	0.781
149BM	H11	0.197	1.714	0.642		149BM	H11	1.843	2.749	0.743
149BM	H12	0.088	1.844	0.69		149BM	H12	1.972	2.655	0.807
150BM	C1	1.028	1.469	0.584		150BM	C1	0.255	1.579	0.117
150BM	H1	0.98	1.378	0.621		150BM	H1	0.25	1.682	0.081
150BM	H2	1.133	1.442	0.571		150BM	H2	0.236	1.516	0.03
150BM	C2	1.017	1.583	0.686		150BM	C2	0.147	1.56	0.217
150BM	H3	1.04	1.679	0.639		150BM	H3	0.147	1.463	0.266
150BM	H4	0.914	1.592	0.72		150BM	H4	0.167	1.628	0.3
150BM	C3	1.108	1.564	0.808		150BM	C3	0.01	1.601	0.169
150BM	O1	0.978	1.511	0.457		150BM	O1	0.385	1.572	0.179
150BM	C4	0.841	1.473	0.439		150BM	C4	0.483	1.582	0.077
150BM	H5	0.829	1.365	0.444		150BM	H5	0.588	1.591	0.104
150BM	H6	0.776	1.518	0.513		150BM	H6	0.479	1.498	0.009
150BM	H7	0.806	1.504	0.34		150BM	H7	0.466	1.67	0.014
150BM	H8	1.211	1.553	0.776		150BM	H8	-0.011	1.541	0.081
150BM	H9	1.082	1.471	0.858		150BM	H9	0.028	1.703	0.136
150BM	C5	1.098	1.68	0.908		150BM	C5	-0.104	1.601	0.266
150BM	H10	0.996	1.691	0.946		150BM	H10	-0.125	1.503	0.309
150BM	H11	1.163	1.664	0.994		150BM	H11	-0.1	1.676	0.345
150BM	H12	1.126	1.775	0.861		150BM	H12	-0.194	1.615	0.206
151BM	C1	2.83	2.656	2.015		151BM	C1	1.895	2.398	2.294
151BM	H1	2.866	2.75	1.973		151BM	H1	1.901	2.295	2.259
151BM	H2	2.918	2.603	2.053		151BM	H2	1.897	2.447	2.197
151BM	C2	2.764	2.569	1.908		151BM	C2	2.017	2.448	2.372
151BM	H3	2.687	2.624	1.854		151BM	H3	2.108	2.43	2.314
151BM	H4	2.842	2.55	1.834		151BM	H4	2.005	2.556	2.372
151BM	C3	2.716	2.433	1.96		151BM	C3	2.026	2.373	2.503
151BM	O1	2.733	2.679	2.117		151BM	O1	1.774	2.425	2.369
151BM	C4	2.798	2.718	2.238		151BM	C4	1.662	2.375	2.302
151BM	H5	2.843	2.817	2.229		151BM	H5	1.572	2.394	2.361
151BM	H6	2.728	2.719	2.321		151BM	H6	1.638	2.426	2.21
151BM	H7	2.877	2.648	2.267		151BM	H7	1.671	2.269	2.277
151BM	H8	2.723	2.427	2.069		151BM	H8	2.039	2.269	2.475
151BM	H9	2.785	2.357	1.924		151BM	H9	1.931	2.37	2.557
151BM	C5	2.575	2.396	1.914		151BM	C5	2.153	2.42	2.582
151BM	H10	2.569	2.39	1.805		151BM	H10	2.183	2.344	2.655
151BM	H11	2.548	2.297	1.951		151BM	H11	2.24	2.431	2.517
151BM	H12	2.498	2.466	1.946		151BM	H12	2.128	2.514	2.631
152BM	C1	2.214	2.713	0.752		152BM	C1	1.242	2.368	0.67
152BM	H1	2.126	2.744	0.81		152BM	H1	1.261	2.303	0.755
152BM	H2	2.179	2.673	0.657		152BM	H2	1.267	2.322	0.575
152BM	C2	2.292	2.607	0.831		152BM	C2	1.335	2.492	0.681
152BM	H3	2.385	2.586	0.778		152BM	H3	1.306	2.566	0.606
152BM	H4	2.323	2.647	0.927		152BM	H4	1.328	2.543	0.777
152BM	C3	2.215	2.476	0.851		152BM	C3	1.486	2.458	0.667
152BM	O1	2.301	2.821	0.731		152BM	O1	1.103	2.402	0.667
152BM	C4	2.24	2.936	0.675		152BM	C4	1.064	2.442	0.8
152BM	H5	2.162	2.976	0.741		152BM	H5	1.069	2.368	0.88
152BM	H6	2.315	3.015	0.662		152BM	H6	1.11	2.534	0.834
152BM	H7	2.197	2.915	0.577		152BM	H7	0.961	2.478	0.804
152BM	H8	2.181	2.439	0.755		152BM	H8	1.544	2.538	0.622
152BM	H9	2.127	2.493	0.912		152BM	H9	1.493	2.38	0.592
152BM	C5	2.302	2.368	0.916		152BM	C5	1.566	2.42	0.796
152BM	H10	2.348	2.404	1.008		152BM	H10	1.576	2.511	0.855
152BM	H11	2.244	2.279	0.939		152BM	H11	1.53	2.345	0.866
152BM	H12	2.383	2.338	0.849		152BM	H12	1.664	2.383	0.767
153BM	C1	1.895	1.307	0.767		153BM	C1	0.942	2.025	0.635
153BM	H1	1.787	1.295	0.758		153BM	H1	0.918	2.101	0.561
153BM	H2	1.92	1.407	0.731		153BM	H2	1.021	2.064	0.7
153BM	C2	1.965	1.201	0.682		153BM	C2	0.995	1.893	0.567
153BM	H3	2.072	1.22	0.687		153BM	H3	1.025	1.813	0.635
153BM	H4	1.951	1.102	0.726		153BM	H4	0.911	1.847	0.516
153BM	C3	1.918	1.199	0.536		153BM	C3	1.108	1.929	0.464
153BM	O1	1.936	1.294	0.902		153BM	O1	0.825	2.001	0.717
153BM	C4	1.851	1.362	0.992		153BM	C4	0.793	2.128	0.778
153BM	H5	1.755	1.312	1.002		153BM	H5	0.695	2.124	0.827
153BM	H6	1.897	1.365	1.091		153BM	H6	0.861	2.162	0.856
153BM	H7	1.833	1.465	0.961		153BM	H7	0.782	2.206	0.703
153BM	H8	1.915	1.3	0.495		153BM	H8	1.075	2	0.389
153BM	H9	1.816	1.16	0.532		153BM	H9	1.113	1.836	0.406
153BM	C5	2.006	1.112	0.446		153BM	C5	1.247	1.961	0.539
153BM	H10	2.016	1.01	0.485		153BM	H10	1.246	2.042	0.612
153BM	H11	1.963	1.103	0.346		153BM	H11	1.282	1.88	0.603
153BM	H12	2.106	1.153	0.435		153BM	H12	1.334	1.977	0.476
154BM	C1	1.923	0.466	2.494		154BM	C1	0.746	0.218	2.915
154BM	H1	2.029	0.471	2.467		154BM	H1	0.72	0.324	2.917
154BM	H2	1.877	0.39	2.429		154BM	H2	0.655	0.158	2.917
154BM	C2	1.858	0.602	2.467		154BM	C2	0.835	0.185	3.033
154BM	H3	1.753	0.603	2.497		154BM	H3	0.873	0.084	3.046
154BM	H4	1.908	0.679	2.527		154BM	H4	0.932	0.234	3.023
154BM	C3	1.869	0.64	2.319		154BM	C3	0.773	0.229	3.172
154BM	O1	1.909	0.429	2.63		154BM	O1	0.816	0.199	2.791
154BM	C4	1.974	0.304	2.656		154BM	C4	0.806	0.07	2.732
154BM	H5	2.081	0.31	2.635		154BM	H5	0.703	0.041	2.711
154BM	H6	1.963	0.274	2.76		154BM	H6	0.861	0.054	2.639
154BM	H7	1.932	0.224	2.594		154BM	H7	0.832	-0.01	2.801
154BM	H8	1.806	0.574	2.259		154BM	H8	0.673	0.184	3.178
154BM	H9	1.971	0.625	2.283		154BM	H9	0.763	0.337	3.167
154BM	C5	1.829	0.785	2.292		154BM	C5	0.858	0.192	3.29
154BM	H10	1.894	0.854	2.346		154BM	H10	0.955	0.241	3.281
154BM	H11	1.839	0.809	2.186		154BM	H11	0.81	0.222	3.383
154BM	H12	1.727	0.806	2.322		154BM	H12	0.886	0.087	3.292
155BM	C1	2.661	2.678	2.629		155BM	C1	1.712	0.457	2.826
155BM	H1	2.702	2.645	2.725		155BM	H1	1.639	0.39	2.873
155BM	H2	2.736	2.742	2.582		155BM	H2	1.652	0.464	2.736
155BM	C2	2.53	2.755	2.649		155BM	C2	1.85	0.404	2.806
155BM	H3	2.497	2.796	2.554		155BM	H3	1.897	0.418	2.903
155BM	H4	2.453	2.684	2.68		155BM	H4	1.833	0.301	2.774
155BM	C3	2.541	2.868	2.752		155BM	C3	1.915	0.488	2.699
155BM	O1	2.631	2.566	2.548		155BM	O1	1.715	0.58	2.899
155BM	C4	2.744	2.482	2.529		155BM	C4	1.584	0.628	2.928
155BM	H5	2.78	2.442	2.624		155BM	H5	1.562	0.692	2.843
155BM	H6	2.719	2.398	2.464		155BM	H6	1.508	0.552	2.941
155BM	H7	2.826	2.536	2.482		155BM	H7	1.585	0.695	3.014
155BM	H8	2.596	2.953	2.71		155BM	H8	1.933	0.587	2.741
155BM	H9	2.6	2.836	2.839		155BM	H9	1.854	0.49	2.608
155BM	C5	2.403	2.914	2.801		155BM	C5	2.048	0.418	2.663
155BM	H10	2.346	2.831	2.841		155BM	H10	2.02	0.344	2.588
155BM	H11	2.413	2.987	2.881		155BM	H11	2.128	0.489	2.642
155BM	H12	2.345	2.96	2.721		155BM	H12	2.099	0.383	2.752
156LI	LI	0.364	2.194	1.196		156LI	LI	0.376	2.964	2.081
157LI	LI	0.155	2.905	0.964		157LI	LI	0.337	0.063	1.299
158LI	LI	2.538	2.323	2.962		158LI	LI	0.616	2.576	0.122
159LI	LI	2.031	0.016	1.828		159LI	LI	1.897	0.016	1.392
160LI	LI	2.808	1.68	1.201		160LI	LI	0.746	2.068	1.492
161LI	LI	1.843	0.513	2.756		161LI	LI	0.908	0.326	2.702
162LI	LI	1.074	1.599	0.343		162LI	LI	0.454	1.622	0.333
163LI	LI	1.579	1.826	0.425		163LI	LI	0.714	1.265	0.321
164LI	LI	0.071	0.165	0.475		164LI	LI	2.958	2.799	1.293
165LI	LI	1.108	0.877	1.318		165LI	LI	1.482	0.316	1.497
166LI	LI	0.623	0.244	1.309		166LI	LI	1.009	2.822	1.208
167LI	LI	2.601	0.38	1.471		167LI	LI	2.574	2.829	1.629
168LI	LI	1.232	0.136	2.604		168LI	LI	0.511	1.242	2.659
169LI	LI	1.369	0.303	0.541		169LI	LI	0.47	0.694	3.025
170LI	LI	2.875	0.992	1.311		170LI	LI	0.485	1.888	1.857
171LI	LI	3.049	2.563	0.607		171LI	LI	3.018	0.002	1.713
172LI	LI	1.636	1.447	0.65		172LI	LI	0.71	1.885	0.732
173LI	LI	0.631	2.729	0.809		173LI	LI	0.554	2.628	1.266
174LI	LI	0.5	1.969	1.645		174LI	LI	0.424	2.44	2.085
175LI	LI	0.877	2.092	2.782		175LI	LI	0.292	2.129	0.11
176LI	LI	1.345	2.522	1.214		176LI	LI	1.173	2.776	1.72
177LI	LI	1.347	1.426	1.498		177LI	LI	1.916	0.386	1.813
178LI	LI	0.617	1.932	2.334		178LI	LI	0.4	2.519	2.689
179LI	LI	0.053	1.626	2.682		179LI	LI	0.128	1.707	2.48
180LI	LI	2.001	2.565	1.554		180LI	LI	1.257	2.807	2.438
181LI	LI	2.577	2.669	2.054		181LI	LI	0.973	0.213	2.226
182LI	LI	0.321	2.477	2.747		182LI	LI	0.776	2.377	2.421
183LI	LI	2.062	1.096	1.569		183LI	LI	0.638	1.639	1.197
184LI	LI	1.827	2.902	2.996		184LI	LI	0.593	0.677	2.597
185LI	LI	0.886	3.027	2.214		185LI	LI	0.327	1.167	3.028
