0 mol 26 unq 0 iso 0 dist 8.54885 7.37634 14.5663 5.08675 6.89136 12.3794 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 3.68549 8.15347 6.61952 6.21952 6.88974 12.1447 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 3.68549 8.15347 6.61952 5.06613 5.5814 5.80534 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.06275 9.72346 9.86609 6.41579 8.38387 14.8727 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.27156 8.32519 5.9487 8.33049 8.1599 6.35779 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.27307 5.38363 8.67853 5.10938 5.47319 5.75135 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 6.92837 5.38363 10.8149 5.10938 9.8809 5.75135 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.96446 4.96173 11.3522 5.27016 8.4545 7.29864 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 6.70686 4.96173 10.0591 5.27016 7.01176 7.29864 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.49531 8.6356 12.6805 4.84407 8.69069 11.8578 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 7.42474 6.79584 13.1881 6.92638 7.53905 13.2998 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 5.06555 8.0889 5.61274 8.75149 7.04864 11.0505 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 8.3127 9.00141 10.803 3.56535 8.01677 11.7914 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 8.3127 4.26814 4.48309 3.56535 8.01677 5.38983 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.52413 8.86574 4.04122 16.5529 8.03995 11.7368 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 6.45574 8.28824 4.75609 9.7911 8.48065 8.1174 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.82778 9.0495 4.61469 12.0443 6.44212 5.17335 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 6.90245 7.65636 4.07839 3.92006 9.10633 8.49869 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 8.49415 9.40917 5.94366 8.73438 9.772 9.81436 numMergedOcc 0
19 mol 265 unq 1 iso 0 dist 8.49415 5.44039 7.71667 8.73438 9.772 5.8898 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 7.77765 7.0445 14.5847 6.22911 7.98617 11.9985 numMergedOcc 0
