Tag	Symbol	X	Y	Z
1	N	-4.612854	-0.779553	-0.25849
2	S	-6.122709	-1.099394	0.194694
3	S	-3.328438	-1.471008	0.365775
4	O	-7.014933	-0.377465	-0.686374
5	O	-3.410918	-2.013624	1.708624
6	O	-6.379501	-1.116192	1.621923
7	O	-2.168033	-0.651569	0.027016
8	F	-6.307068	-2.694458	-0.255961
9	F	-3.132031	-2.795987	-0.589186
10	N	3.069264	-2.649361	-1.072484
11	S	1.798914	-2.519097	-0.126929
12	S	4.167838	-3.81822	-0.952696
13	O	1.02354	-1.374939	-0.601204
14	O	4.310829	-4.463345	0.338788
15	O	1.997052	-2.658446	1.303902
16	O	5.341206	-3.413775	-1.697105
17	F	0.863177	-3.813947	-0.52776
18	F	3.48662	-5.000288	-1.904466
19	N	-0.574619	4.081747	-1.686992
20	S	-0.087394	2.593565	-1.969578
21	S	-0.123349	4.966749	-0.427162
22	O	-0.585603	2.163722	-3.252198
23	O	0.371403	4.254441	0.738954
24	O	-0.176355	1.678279	-0.831469
25	O	-1.063855	6.05445	-0.266502
26	F	1.550701	2.741971	-2.167616
27	F	1.23714	5.713029	-1.026469
28	C	1.588433	0.579289	2.409807
29	O	0.297782	0.167069	1.957703
30	C	-0.336542	-0.679352	2.921768
31	C	2.213755	1.508899	1.374814
32	C	3.521551	2.080473	1.855321
33	F	4.093276	2.88663	0.936186
34	F	3.381222	2.822008	2.990406
35	F	4.439146	1.118715	2.152421
36	H	1.472536	1.105736	3.365828
37	H	2.211437	-0.307433	2.570078
38	H	-1.317987	-0.945667	2.538635
39	H	0.256481	-1.586703	3.075975
40	H	-0.451942	-0.142829	3.871904
41	H	2.412353	0.976531	0.442261
42	H	1.548048	2.345304	1.154044
43	Li	-0.318331	-0.060031	0.008888
