14NH3 Uncertainty threshold: 0.0005 cm^(-1) |H_0| = 2497 Summary: Component #299: 20 vertices. Path length: 1. Utility factor = 20 Component #13: 32 vertices. Path length: 2. Utility factor = 16 Component #14: 27 vertices. Path length: 2. Utility factor = 13.5 Component #437: 10 vertices. Path length: 1. Utility factor = 10 Component #431: 9 vertices. Path length: 1. Utility factor = 9 Component #82: 9 vertices. Path length: 1. Utility factor = 9 Component #435: 8 vertices. Path length: 1. Utility factor = 8 Component #397: 16 vertices. Path length: 2. Utility factor = 8 Component #433: 9 vertices. Path length: 2. Utility factor = 4.5 ============== Component #299: 20 vertices. Path length: 1. Utility factor = 20 --- 1 1 314.8911060000 1.079e-03 0 1 0 0 0 0 17 5 s E" 25 0 1 0 0 0 0 16 5 a E' 23 16SuYuPePi.669 1 1 314.8913500000 8.233e-04 0 1 0 0 0 0 17 5 s E" 25 0 1 0 0 0 0 16 5 a E' 23 10YuPeDrSu_S2.756 1 1 341.8481000000 2.809e-03 0 0 0 0 0 0 18 5 a E' 9 0 0 0 0 0 0 17 5 s E" 10 10YuPeDrSu_S2.888 1 1 1272.8399000000 3.475e-03 0 1 0 0 0 0 17 5 s E" 25 0 0 0 0 0 0 16 5 a E' 8 86UrCuMaRa.182 1 1 1272.8422850000 1.000e-03 0 1 0 0 0 0 17 5 s E" 25 0 0 0 0 0 0 16 5 a E' 8 11ZoShOvPo.2385 1 1 1298.5606690000 1.000e-03 0 1 0 0 0 0 18 5 a E' 28 0 0 0 0 0 0 17 5 s E" 10 11ZoShOvPo.2495 1 1 1298.5618000000 1.967e-03 0 1 0 0 0 0 18 5 a E' 28 0 0 0 0 0 0 17 5 s E" 10 86UrCuMaRa.86 --- ============== Component #13: 32 vertices. Path length: 2. Utility factor = 16 --- 1 1 1569.5184330000 2.500e-02 0 0 0 1 0 1 17 15 s E" 26 0 0 0 0 0 0 17 14 s E' 3 11ZoShOvPo.4097 1 1 1901.6191410000 2.500e-02 0 0 0 1 0 1 17 15 s E" 26 0 0 0 0 0 0 16 14 s E' 2 11ZoShOvPo.5987 --- 1 2 1555.7552490000 1.000e-03 0 0 0 1 0 1 17 15 s E" 26 0 0 0 0 0 0 18 17 a E' 1 11ZoShOvPo.3998 --- ============== Component #14: 27 vertices. Path length: 2. Utility factor = 13.5 --- 1 1 1554.8902590000 2.000e-03 0 0 0 1 0 1 17 16 s A2' 11 0 0 0 0 0 0 17 15 s A2" 1 11ZoShOvPo.6126 1 1 1888.4852300000 5.000e-04 0 0 0 1 0 1 17 16 s A2' 11 0 0 0 0 0 0 16 15 s A2" 1 11ZoShOvPo.6134 --- 1 2 1566.4092000000 3.000e-03 0 0 0 1 0 1 17 16 s A2' 11 0 0 0 0 0 0 18 18 a A2" 1 84UrCuNaPa.952 --- ============== Component #437: 10 vertices. Path length: 1. Utility factor = 10 --- 1 1 404.7436200000 5.286e-04 0 1 0 0 0 0 22 4 s E' 44 0 1 0 0 0 0 21 4 a E" 39 10YuPeDrSu_S2.1221 1 1 408.2291800000 1.608e-03 0 0 0 0 0 0 22 4 s E' 18 0 0 0 0 0 0 21 4 a E" 14 10YuPeDrSu_S2.1245 1 1 547.0386510000 7.795e-04 0 1 0 0 0 0 21 4 a E" 39 0 0 0 0 0 0 22 4 s E' 18 10YuPeDrSu_S2.1911 1 1 1360.0140380000 1.000e-03 0 1 0 0 0 0 22 4 s E' 44 0 0 0 0 0 0 21 4 a E" 14 11ZoShOvPo.2727 --- ============== Component #431: 9 vertices. Path length: 1. Utility factor = 9 --- 1 1 387.9624300000 1.936e-03 0 1 0 0 0 0 21 6 s A2' 19 0 1 0 0 0 0 20 6 a A2" 17 10YuPeDrSu_S2.1138 1 1 409.2190600000 1.311e-03 0 0 0 0 0 0 22 6 a A2" 8 0 0 0 0 0 0 21 6 s A2' 8 10YuPeDrSu_S2.1257 1 1 952.7871090000 1.054e-02 0 1 0 0 0 0 23 6 a A2" 21 0 0 0 0 0 0 23 6 s A2' 9 11ZoShOvPo.992 1 1 1342.8176270000 1.000e-03 0 1 0 0 0 0 21 6 s A2' 19 0 0 0 0 0 0 20 6 a A2" 6 11ZoShOvPo.2643 1 1 1342.8488890000 3.237e-02 0 1 0 0 0 0 21 6 s A2' 19 0 0 0 0 0 0 20 6 a A2" 6 15BaYuTeCl.1192 1 1 1362.7166750000 1.000e-03 0 1 0 0 0 0 22 6 a A2" 20 0 0 0 0 0 0 21 6 s A2' 8 11ZoShOvPo.2752 --- ============== Component #82: 9 vertices. Path length: 1. Utility factor = 9 --- 1 1 6.9974990000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 2 0 0 0 0 11 6 a A2" 17 13DoHiYuTe.202 1 1 155.4026100000 2.337e-02 0 2 0 0 0 0 13 6 a A2" 21 0 2 0 0 0 0 12 3 a A2' 20 13DoHiYuTe.1730 1 1 188.1731430000 3.024e-03 0 2 0 0 0 0 12 6 s A2' 14 0 2 0 0 0 0 12 9 s A2" 13 13DoHiYuTe.2006 1 1 192.5914300000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 5 s A2" 12 16PeYuPi_S3.301 1 1 192.5916800000 6.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 5 s A2" 12 16PeYuPi_S2.1985 1 1 192.5921370000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 5 s A2" 12 16SuYuPePi.1669 1 1 223.6082000000 1.000e-03 0 2 0 0 0 0 12 6 a A2" 22 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S3.419 1 1 223.6082600000 1.000e-03 0 2 0 0 0 0 12 6 a A2" 22 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S3.420 1 1 223.6083700000 1.000e-03 0 2 0 0 0 0 12 6 a A2" 22 0 2 0 0 0 0 12 6 s A2' 14 16SuYuPePi.817 1 1 223.6085300000 6.000e-04 0 2 0 0 0 0 12 6 a A2" 22 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S2.2070 1 1 223.6086430000 1.000e-03 0 2 0 0 0 0 12 6 a A2" 22 0 2 0 0 0 0 12 6 s A2' 14 13DoHiYuTe.2266 1 1 242.5445100000 1.000e-03 0 0 0 1 0 1 13 7 s A2" 15 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S3.545 1 1 242.5448400000 6.000e-04 0 0 0 1 0 1 13 7 s A2" 15 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S2.2158 1 1 242.5449600000 1.000e-03 0 0 0 1 0 1 13 7 s A2" 15 0 2 0 0 0 0 12 6 s A2' 14 16SuYuPePi.1715 1 1 252.8139200000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 7 s A2" 11 16PeYuPi_S3.607 1 1 252.8140800000 6.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 7 s A2" 11 16PeYuPi_S2.2199 1 1 252.8141090000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 1 0 1 11 7 s A2" 11 16SuYuPePi.1667 1 1 306.1785070000 1.000e-03 0 0 0 1 0 1 13 5 s A2" 16 0 2 0 0 0 0 12 6 s A2' 14 16SuYuPePi.1722 1 1 306.1787400000 6.000e-04 0 0 0 1 0 1 13 5 s A2" 16 0 2 0 0 0 0 12 6 s A2' 14 16PeYuPi_S2.2391 1 1 338.9556440000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 13 3 s A2" 8 13DoHiYuTe.2878 1 1 401.1346970000 1.000e-03 0 2 0 0 0 0 14 6 s A2' 16 0 1 0 0 0 0 15 6 a A2" 10 16SuYuPePi.197 1 1 406.3867620000 2.109e-03 0 2 0 0 0 0 13 6 a A2" 21 0 2 0 0 0 0 12 9 a A2' 16 13DoHiYuTe.3152 1 1 419.5086000000 1.224e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 13 6 a A2" 7 16PeYuPi_S3.1090 1 1 419.5094700000 6.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 13 6 a A2" 7 16PeYuPi_S2.2520 1 1 419.5094870000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 13 6 a A2" 7 16SuYuPePi.145 1 1 419.6852340000 1.000e-03 0 2 0 0 0 0 13 6 a A2" 21 0 0 0 1 0 1 12 5 a A2' 15 16SuYuPePi.1717 1 1 432.4911130000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 2 0 0 0 0 11 9 s A2" 9 13DoHiYuTe.3262 1 1 465.6274840000 2.776e-02 0 2 0 0 0 0 14 6 s A2' 16 0 2 0 0 0 0 13 9 s A2" 12 13DoHiYuTe.3421 1 1 485.6667170000 1.166e-03 0 3 0 0 0 0 12 6 s A2' 24 0 2 0 0 0 0 12 6 a A2" 22 18PeYuPeSu.55 1 1 491.1230010000 1.000e-03 0 2 0 0 0 0 13 6 a A2" 21 0 0 0 1 0 1 12 7 a A2' 13 16SuYuPePi.1716 1 1 507.8006490000 1.366e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 15 3 a A2' 12 13DoHiYuTe.3670 1 1 527.3112250000 3.596e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 3 a A2' 9 13DoHiYuTe.3775 1 1 592.4487290000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 3 s A2" 9 13DoHiYuTe.4204 1 1 614.8304240000 1.326e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 15 6 s A2' 10 13DoHiYuTe.4372 1 1 614.8432100000 1.000e-03 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 15 6 s A2' 10 16PeYuPi_S3.1324 1 1 614.8447620000 1.860e-03 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 15 6 s A2' 10 16SuYuPePi.196 1 1 637.7644400000 1.705e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 6 s A2' 7 16PeYuPi_S3.1357 1 1 637.7659700000 1.000e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 6 s A2' 7 16SuYuPePi.167 1 1 637.7660800000 6.000e-04 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 6 s A2' 7 16PeYuPi_S2.2798 1 1 637.7816580000 1.674e-02 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 6 s A2' 7 15BaYuTeCl.222 1 1 671.6551900000 1.465e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 6 a A2" 8 16PeYuPi_S3.1432 1 1 671.6566300000 6.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 6 a A2" 8 16PeYuPi_S2.2866 1 1 671.6575000000 1.469e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 6 a A2" 8 86HeBiBa.117 1 1 671.6805700000 2.542e-02 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 6 a A2" 8 15BaYuTeCl.273 1 1 716.2707200000 1.806e-03 0 3 0 0 0 0 12 6 s A2' 24 0 2 0 0 0 0 11 6 a A2" 17 18PeYuPeSu.56 1 1 759.6033900000 1.375e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 15 9 a A2' 9 13DoHiYuTe.6003 1 1 779.3511910000 3.460e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 13 0 s A2' 10 13DoHiYuTe.6246 1 1 781.9001290000 2.923e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 14 9 a A2' 6 13DoHiYuTe.6281 1 1 795.2687310000 1.361e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 14 3 a A2' 9 13DoHiYuTe.6443 1 1 797.0194950000 2.897e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 13 3 a A2' 9 13DoHiYuTe.6462 1 1 827.4739810000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 11 3 s A2" 6 13DoHiYuTe.6842 1 1 863.3139170000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 12 9 s A2" 7 13DoHiYuTe.7298 1 1 905.7341310000 1.331e-03 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 14 6 s A2' 7 11ZoShOvPo.381 1 1 910.7146610000 1.000e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 13 6 s A2' 8 11ZoShOvPo.432 1 1 910.7206290000 1.000e-02 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 13 6 s A2' 8 15BaYuTeCl.644 1 1 960.2421880000 1.000e-03 0 2 0 0 0 0 14 6 s A2' 16 0 1 0 0 0 0 13 6 a A2" 7 11ZoShOvPo.1141 1 1 967.2142330000 1.221e-03 0 3 0 0 0 0 11 6 a A2" 29 0 2 0 0 0 0 12 6 s A2' 14 11ZoShOvPo.1235 1 1 971.0130620000 2.404e-02 0 3 0 0 0 0 13 6 s A2' 28 0 0 0 1 0 1 12 7 s A2" 16 11ZoShOvPo.1251 1 1 1047.3086970000 1.310e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 13 0 s A2' 10 13DoHiYuTe.9599 1 1 1048.2158550000 2.967e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 12 3 a A2' 8 13DoHiYuTe.9610 1 1 1049.8576350000 1.418e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 14 9 a A2' 6 13DoHiYuTe.9624 1 1 1053.9382540000 2.990e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 13 9 a A2' 7 13DoHiYuTe.9652 1 1 1064.9770010000 1.273e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 13 3 a A2' 9 13DoHiYuTe.9751 1 1 1101.9321450000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 1 0 0 0 0 11 9 s A2" 4 13DoHiYuTe.10028 1 1 1105.6727300000 2.506e-02 0 3 0 0 0 0 13 6 s A2' 28 0 1 0 0 0 0 14 6 a A2" 8 11ZoShOvPo.1717 1 1 1128.7841800000 1.000e-03 0 3 0 0 0 0 12 6 s A2' 24 0 1 0 0 0 0 13 6 a A2" 7 11ZoShOvPo.1820 1 1 1165.4710690000 1.000e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 12 6 s A2' 7 11ZoShOvPo.1981 1 1 1178.6828610000 1.105e-03 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 13 6 s A2' 8 11ZoShOvPo.2047 1 1 1188.2847400000 2.894e-03 0 3 0 0 0 0 12 6 a A2" 36 0 2 0 0 0 0 12 6 s A2' 14 18PeYuPeSu.757 1 1 1188.2856450000 1.989e-03 0 3 0 0 0 0 12 6 a A2" 36 0 2 0 0 0 0 12 6 s A2' 14 11ZoShOvPo.2068 1 1 1307.5299490000 3.139e-03 0 2 0 0 0 0 13 6 a A2" 21 0 1 0 0 0 0 12 9 a A2' 6 13DoHiYuTe.10573 1 1 1321.8957600000 1.294e-02 0 2 0 0 0 0 14 6 a A2" 24 0 1 0 0 0 0 13 9 a A2' 7 13DoHiYuTe.10581 1 1 1380.9299320000 1.439e-03 0 3 0 0 0 0 12 6 s A2' 24 0 1 0 0 0 0 12 6 a A2" 8 11ZoShOvPo.2872 1 1 1559.5927730000 8.204e-03 0 2 0 0 0 0 14 6 a A2" 24 0 0 0 0 0 0 15 6 s A2' 4 11ZoShOvPo.4021 1 1 1580.9689940000 1.192e-03 0 2 0 0 0 0 13 6 a A2" 21 0 0 0 0 0 0 14 6 s A2' 3 11ZoShOvPo.4193 1 1 1614.5184330000 1.757e-03 0 3 0 0 0 0 12 6 s A2' 24 0 1 0 0 0 0 11 6 a A2" 5 11ZoShOvPo.4561 1 1 1628.3154300000 2.169e-02 0 3 0 0 0 0 13 6 s A2' 28 0 1 0 0 0 0 12 6 a A2" 8 11ZoShOvPo.4740 1 1 1631.7657470000 1.000e-03 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 0 0 0 12 6 a A2" 3 11ZoShOvPo.4784 1 1 1631.7658300000 5.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 0 0 0 12 6 a A2" 3 00CoKlTaBr.574 1 1 1648.4468990000 1.000e-03 0 2 0 0 0 0 14 6 s A2' 16 0 0 0 0 0 0 14 6 a A2" 3 11ZoShOvPo.4962 1 1 1866.0931800000 5.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 0 0 0 11 6 a A2" 2 00CoKlTaBr.1088 1 1 1866.0932000000 5.000e-04 0 2 0 0 0 0 12 6 s A2' 14 0 0 0 0 0 0 11 6 a A2" 2 87LeLaGuTa.201 1 1 2088.1767300000 1.543e-03 0 3 0 0 0 0 12 6 s A2' 24 0 0 0 0 0 0 13 6 a A2" 3 95KlTaBr.730 1 1 2575.3680000000 5.267e-04 0 3 0 0 0 0 12 6 s A2' 24 0 0 0 0 0 0 11 6 a A2" 2 95KlTaBr.1438 --- ============== Component #435: 8 vertices. Path length: 1. Utility factor = 8 --- 1 1 400.8081100000 5.706e-03 0 0 0 0 0 0 21 14 a E" 5 0 0 0 0 0 0 20 14 s E' 5 10YuPeDrSu_S2.1205 1 1 944.7299190000 1.000e-03 0 1 0 0 0 0 22 14 a E" 25 0 0 0 0 0 0 22 14 s E' 7 11ZoShOvPo.857 --- ============== Component #397: 16 vertices. Path length: 2. Utility factor = 8 --- 1 1 1058.9283450000 1.231e-03 0 2 0 0 0 0 17 3 s A2" 27 0 1 0 0 0 0 16 3 a A2' 12 11ZoShOvPo.1533 --- 1 2 1352.9412840000 1.601e-03 0 2 0 0 0 0 17 3 s A2" 27 0 0 0 0 0 0 18 3 a A2' 7 11ZoShOvPo.2695 --- --- 2 1 1102.6301270000 1.000e-03 0 2 0 0 0 0 19 6 s A2' 31 0 1 0 0 0 0 18 6 a A2" 16 11ZoShOvPo.1701 2 1 1323.2860110000 1.000e-03 0 2 0 0 0 0 19 6 s A2' 31 0 0 0 0 0 0 20 6 a A2" 6 11ZoShOvPo.2571 --- 2 2 1611.4477540000 1.601e-03 0 2 0 0 0 0 19 6 s A2' 31 0 0 0 0 0 0 19 3 s A2" 7 11ZoShOvPo.4524 ---