0 mol 53 unq 0 iso 0 dist 7.57227 5.06506 7.72123 5.01743 8.79235 7.13301 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 5.75102 5.31671 9.3877 6.52737 7.50921 5.26906 numMergedOcc 0
2 mol 71 unq 1 iso 0 dist 8.80254 7.01416 9.3877 10.212 7.50921 5.26906 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.07757 10.1228 9.47394 5.80449 9.11547 7.18582 numMergedOcc 0
4 mol 95 unq 1 iso 0 dist 9.07757 10.1228 9.47394 12.9542 8.23073 13.4088 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 7.14447 4.73274 5.52837 3.48657 8.62632 4.78213 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.98221 5.29106 8.72113 3.64178 9.77333 5.62911 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 5.99974 10.3962 8.43359 8.02616 5.08603 9.58574 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 5.99974 10.3962 8.43359 13.6686 9.30889 5.53973 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 8.51497 9.50163 8.30095 6.04052 8.44337 4.0847 numMergedOcc 0
10 mol 198 unq 0 iso 0 dist 8.74957 11.6419 8.73074 5.8901 7.7619 13.3819 numMergedOcc 0
11 mol 198 unq 1 iso 0 dist 7.91967 15.0552 8.73074 5.9839 7.7619 13.3819 numMergedOcc 0
12 mol 198 unq 2 iso 0 dist 7.83611 7.54337 8.73074 15.4093 7.7619 13.3819 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 7.72756 9.55542 7.24135 6.01994 6.63935 3.72487 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 7.5696 6.67496 7.30459 9.19007 5.81438 3.93117 numMergedOcc 0
15 mol 204 unq 2 iso 0 dist 7.5696 6.81615 8.73423 9.19007 5.81438 11.1412 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 7.19924 9.3643 6.17408 6.14152 5.99355 4.21942 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 7.19924 9.47569 6.17602 6.14152 5.99355 3.93622 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.27377 9.97671 8.2681 10.7913 8.59229 10.3367 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 8.27377 9.97671 8.2681 10.1431 7.33165 5.12941 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 8.27377 9.97671 8.2681 5.9617 9.66967 9.06733 numMergedOcc 0
