0 mol 7 unq 0 iso 0 dist 7.13259 3.92058 9.4095 10.4548 9.60361 8.54246 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.49232 15.7777 9.4095 16.3136 9.60361 8.54246 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 7.4379 12.1963 8.91798 8.46092 7.41235 4.03579 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 7.4379 12.1963 8.91798 4.72607 9.00377 10.7986 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 7.4379 11.5487 8.54422 8.46092 7.41235 5.02694 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 7.4379 11.5487 8.54422 4.72607 9.00377 9.03463 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 9.57343 16.7996 8.99557 12.7344 9.72136 8.55766 numMergedOcc 0
7 mol 46 unq 1 iso 0 dist 9.57343 16.7996 8.99557 13.9221 4.61355 5.91159 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 7.70782 12.6883 9.68759 6.18292 9.65903 13.6916 numMergedOcc 0
9 mol 81 unq 0 iso 0 dist 6.99027 11.1775 9.1024 6.10195 7.062 7.58448 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 9.06373 4.18707 8.64091 8.03795 8.18122 7.34791 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 9.54996 12.6004 6.52227 13.555 7.20083 3.97541 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 7.33878 13.9243 8.6499 5.13506 9.8506 13.5761 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 7.48646 14.0913 8.75339 5.16426 9.91991 13.6344 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 7.41627 5.09497 9.27706 4.94644 6.89441 5.37149 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.6897 9.46095 8.8495 11.0071 7.63908 7.54616 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 9.6897 8.10536 8.00688 11.0071 7.63908 3.69062 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 8.61758 4.77722 6.99667 10.6488 8.9694 11.5597 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 5.45548 4.77722 6.22499 5.055 8.70011 9.75492 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.27813 11.9858 8.69185 6.70394 9.28828 6.37079 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 5.68392 3.73772 8.69185 5.31928 9.28828 6.37079 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 8.03252 4.46246 8.31953 5.90283 5.74676 3.86293 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.88719 5.50542 9.81603 4.14327 6.01636 9.55219 numMergedOcc 0
