0 mol 28 unq 0 iso 0 dist 6.14086 6.46236 7.82759 4.81564 5.42412 3.97968 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.76158 9.86606 7.82759 6.18197 5.42412 3.97968 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 7.52145 5.26423 6.89423 5.64731 7.72377 4.75331 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 8.35776 14.188 6.89423 12.3204 7.72377 4.75331 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 7.73997 5.3781 9.09778 5.6382 9.39402 9.38166 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 7.12713 8.18746 8.99393 4.50032 7.44805 8.16858 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 9.80453 4.38483 7.32699 15.0045 7.90416 13.3375 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 9.80453 8.2379 6.45933 15.0045 7.90416 8.95658 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 6.08242 10.6501 6.63808 4.64546 8.18584 10.8491 numMergedOcc 0
9 mol 135 unq 1 iso 0 dist 6.08242 10.6501 6.63808 9.29013 9.85803 7.88991 numMergedOcc 0
10 mol 135 unq 2 iso 0 dist 5.60595 7.97354 6.63808 7.61563 8.18584 10.8491 numMergedOcc 0
11 mol 135 unq 3 iso 0 dist 5.60595 7.97354 6.63808 8.84813 9.85803 7.88991 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 6.32254 11.3492 9.95907 13.0176 9.60931 10.5221 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 8.89556 9.65515 9.95907 14.8578 9.60931 10.5221 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.76929 6.01923 7.14918 6.65459 4.44509 4.56036 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.95095 11.3295 5.57978 12.1402 6.90511 10.2996 numMergedOcc 0
16 mol 269 unq 0 iso 0 dist 6.8127 10.3519 5.17111 13.6116 9.20068 5.02427 numMergedOcc 0
17 mol 269 unq 1 iso 0 dist 6.8127 5.36199 7.79735 13.6116 9.20068 10.8859 numMergedOcc 0
