0 mol 24 unq 0 iso 0 dist 7.95042 8.52463 5.80953 13.0257 9.57743 4.90592 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.95042 8.52463 5.80953 6.60423 4.47891 9.36461 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 5.68215 5.11617 6.61696 4.93188 8.10397 4.90592 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 5.68215 5.11617 6.61696 14.156 13.8334 9.36461 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 7.27472 6.7828 9.586 9.24958 5.11135 8.16324 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.12845 6.04762 6.81793 11.8778 9.45442 6.74848 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 9.22598 9.95364 9.01564 14.6584 11.5843 6.62229 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 8.96727 5.49591 9.01564 10.9864 11.5843 6.62229 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 8.01308 5.49591 7.11065 10.9864 7.05093 6.62229 numMergedOcc 0
9 mol 60 unq 0 iso 0 dist 7.57295 9.49968 6.63448 10.0962 5.71764 4.65127 numMergedOcc 0
10 mol 60 unq 1 iso 0 dist 8.4312 5.94827 6.63448 7.55695 5.71764 4.65127 numMergedOcc 0
11 mol 60 unq 2 iso 0 dist 7.48086 5.32257 6.63448 8.82176 5.71764 4.65127 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 8.68662 6.56633 8.96616 8.73253 10.9746 6.48232 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 9.73086 5.11416 6.14542 7.04044 7.8972 6.48232 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 7.4369 6.56633 6.14542 8.73253 7.8972 6.48232 numMergedOcc 0
15 mol 76 unq 0 iso 0 dist 6.72869 4.85247 7.46095 11.2278 6.48293 9.75201 numMergedOcc 0
16 mol 76 unq 1 iso 0 dist 9.85905 6.45686 7.46095 7.27693 6.48293 9.75201 numMergedOcc 0
17 mol 92 unq 0 iso 0 dist 7.13008 10.9681 8.93769 12.26 8.08435 8.29345 numMergedOcc 0
18 mol 105 unq 0 iso 0 dist 9.16718 11.0132 7.77089 14.4953 9.02856 7.09806 numMergedOcc 0
19 mol 105 unq 1 iso 0 dist 7.94633 9.96719 7.77089 15.0224 9.02856 7.09806 numMergedOcc 0
20 mol 112 unq 0 iso 0 dist 9.05166 5.76986 8.72725 13.6135 8.59786 9.77017 numMergedOcc 0
21 mol 112 unq 1 iso 0 dist 5.56994 5.76986 6.11407 13.6135 9.00531 9.77017 numMergedOcc 0
22 mol 119 unq 0 iso 0 dist 9.77575 6.36778 6.18678 12.7667 5.23023 7.12072 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 9.66543 7.1797 9.0176 7.36779 4.935 9.30061 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 7.21868 4.57832 9.0176 8.20836 4.935 9.30061 numMergedOcc 0
25 mol 134 unq 2 iso 0 dist 7.93372 5.29786 9.0176 10.873 4.935 9.30061 numMergedOcc 0
26 mol 141 unq 0 iso 0 dist 8.07097 10.1386 5.92302 6.69515 5.25982 4.46777 numMergedOcc 0
27 mol 141 unq 1 iso 0 dist 8.07097 7.42649 5.29898 6.69515 5.25982 6.94988 numMergedOcc 0
28 mol 162 unq 0 iso 0 dist 7.45998 10.1865 8.33407 15.3135 10.2189 7.58035 numMergedOcc 0
29 mol 162 unq 1 iso 0 dist 7.45998 10.1865 8.33407 15.0931 11.1329 8.21989 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 8.73533 7.30024 9.45907 7.24795 9.40383 7.46987 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 7.2793 10.5063 6.88127 9.83476 6.38897 4.5271 numMergedOcc 0
32 mol 204 unq 0 iso 0 dist 7.9133 5.86489 9.48625 6.85441 9.54203 5.91727 numMergedOcc 0
33 mol 210 unq 0 iso 0 dist 8.63693 7.67559 9.68477 7.63018 6.75621 6.78579 numMergedOcc 0
34 mol 232 unq 0 iso 0 dist 6.71524 4.9377 9.9183 7.83711 8.03712 6.57921 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 7.15764 6.35641 8.09509 6.86945 4.34126 7.39391 numMergedOcc 0
36 mol 274 unq 0 iso 0 dist 9.30212 9.5468 7.77765 11.3823 14.6057 7.79704 numMergedOcc 0
37 mol 274 unq 1 iso 0 dist 9.30212 9.5468 7.77765 10.4834 15.1159 9.39276 numMergedOcc 0
38 mol 274 unq 2 iso 0 dist 6.4611 9.5468 9.65868 11.3823 6.522 7.79704 numMergedOcc 0
39 mol 274 unq 3 iso 0 dist 6.4611 9.5468 9.65868 10.4834 7.44746 9.39276 numMergedOcc 0
40 mol 274 unq 4 iso 0 dist 6.4611 6.70925 8.60027 11.5241 14.9951 8.2997 numMergedOcc 0
41 mol 277 unq 0 iso 0 dist 9.57499 6.28695 9.26157 6.57903 14.6871 7.85414 numMergedOcc 0
42 mol 277 unq 1 iso 0 dist 5.46926 4.37645 9.26157 11.5506 14.6871 7.85414 numMergedOcc 0
43 mol 277 unq 2 iso 0 dist 8.9682 7.70529 9.26157 12.7237 14.6871 7.85414 numMergedOcc 0
