0 mol 1 unq 0 iso 0 dist 5.87976 7.58747 7.81034 8.83387 4.93091 9.21329 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 5.87976 6.38325 9.19497 8.83387 4.93091 8.54277 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 8.71167 10.2917 7.81034 9.85305 4.93091 9.21329 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 8.71167 4.69498 9.19497 9.85305 4.93091 8.54277 numMergedOcc 0
4 mol 2 unq 0 iso 0 dist 5.69072 4.69809 6.47123 9.10202 4.00237 8.3726 numMergedOcc 0
5 mol 17 unq 0 iso 0 dist 6.84727 4.88828 6.3896 8.44037 5.09467 8.90155 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 5.51158 6.69874 5.73363 8.63439 4.10415 9.54171 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 8.72278 9.88342 5.07106 11.3581 3.82644 5.42426 numMergedOcc 0
8 mol 32 unq 1 iso 0 dist 8.72278 8.14778 4.92166 11.3581 3.82644 8.03553 numMergedOcc 0
9 mol 46 unq 0 iso 0 dist 7.19406 4.50032 5.02642 7.12713 9.83606 7.44805 numMergedOcc 0
10 mol 48 unq 0 iso 0 dist 7.55854 5.37112 9.14072 14.0783 12.884 9.40291 numMergedOcc 0
11 mol 48 unq 1 iso 0 dist 7.55854 5.37112 9.14072 13.1628 14.5015 7.94814 numMergedOcc 0
12 mol 48 unq 2 iso 0 dist 7.55854 5.37112 9.14072 14.3835 16.2483 9.55632 numMergedOcc 0
13 mol 48 unq 3 iso 0 dist 5.48669 8.94459 9.14072 15.6481 12.884 9.40291 numMergedOcc 0
14 mol 48 unq 4 iso 0 dist 5.48669 8.94459 9.14072 16.2103 14.5015 7.94814 numMergedOcc 0
15 mol 48 unq 5 iso 0 dist 5.48669 8.94459 9.14072 18.0956 16.2483 9.55632 numMergedOcc 0
16 mol 48 unq 6 iso 0 dist 5.78051 9.49743 9.14072 13.4491 12.884 9.40291 numMergedOcc 0
17 mol 48 unq 7 iso 0 dist 5.78051 9.49743 9.14072 15.1229 14.5015 7.94814 numMergedOcc 0
18 mol 48 unq 8 iso 0 dist 5.78051 9.49743 9.14072 17.6136 16.2483 9.55632 numMergedOcc 0
19 mol 76 unq 0 iso 0 dist 9.0101 4.77004 7.41861 8.26805 9.68005 9.50939 numMergedOcc 0
20 mol 114 unq 0 iso 0 dist 5.99873 5.64342 8.79677 8.18193 6.83136 5.87382 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 9.43988 6.94063 9.1056 6.80203 5.58661 8.82481 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 8.91036 14.4364 6.60418 18.3287 11.5164 9.19939 numMergedOcc 0
23 mol 185 unq 0 iso 0 dist 9.27825 9.44002 8.85182 9.62449 5.80135 9.44685 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 7.83389 14.4767 9.78743 22.3993 16.7863 7.97601 numMergedOcc 0
25 mol 230 unq 0 iso 0 dist 6.97966 4.59722 5.19913 12.764 6.2863 9.62914 numMergedOcc 0
26 mol 230 unq 1 iso 0 dist 6.97966 4.59722 5.19913 13.5297 12.1033 9.73038 numMergedOcc 0
27 mol 266 unq 0 iso 0 dist 9.477 4.47412 9.80006 6.9943 3.87565 9.03341 numMergedOcc 0
