0 mol 7 unq 0 iso 0 dist 8.19144 5.77391 7.31201 11.1673 9.55056 5.44992 11.9671 10.789 7.10621 5.72491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.19144 5.77391 7.31201 11.1673 9.55056 5.44992 17.0751 12.2708 12.2333 7.88043 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.19144 5.77391 7.31201 8.71528 7.57354 4.74523 17.0751 12.2708 12.2333 8.80762 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.84459 10.3415 7.31201 14.7203 9.55056 5.44992 16.4849 10.789 7.10621 5.72491 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.84459 10.3415 7.31201 14.7203 9.55056 5.44992 18.161 12.2708 12.2333 7.88043 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.84459 10.3415 7.31201 10.8725 7.57354 4.74523 18.161 12.2708 12.2333 8.80762 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 6.87582 7.12329 6.99777 5.15368 9.9928 7.3094 9.93482 11.7126 7.88312 5.72642 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 8.77794 5.19652 6.99777 11.9046 9.9928 7.3094 12.9647 11.7126 7.88312 5.72642 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.16039 5.26656 6.79146 7.14836 6.42785 7.55374 13.6645 8.84655 13.7544 8.33077 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 6.16039 5.26656 6.79146 11.923 6.82089 9.44878 14.3553 10.3933 14.5247 9.28592 numMergedOcc 0
10 mol 130 unq 2 iso 0 dist 6.16039 10.6181 7.66168 7.14836 6.42785 11.576 13.6645 8.84655 13.572 8.33077 numMergedOcc 0
11 mol 130 unq 3 iso 0 dist 6.16039 10.6181 7.66168 11.923 6.82089 4.28797 14.3553 10.3933 10.3889 9.28592 numMergedOcc 0
12 mol 130 unq 4 iso 0 dist 6.16039 9.86628 6.89257 7.14836 6.42785 5.97111 13.6645 8.84655 8.70949 8.33077 numMergedOcc 0
13 mol 130 unq 5 iso 0 dist 6.16039 9.86628 6.89257 11.923 6.82089 6.97875 14.3553 10.3933 15.2264 9.28592 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 9.22228 5.22807 6.88137 12.0584 7.04913 7.7635 13.7939 5.07967 10.2717 7.73169 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 9.15536 10.5343 9.31887 14.8807 7.01126 13.9336 16.5107 11.1651 19.63 7.35824 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 9.15536 10.5343 9.31887 9.37871 6.58434 11.873 16.5107 11.1651 19.63 9.17364 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 7.95111 7.25468 9.52936 6.30834 6.21206 8.41716 10.8463 6.47974 15.173 8.77887 numMergedOcc 0
18 mol 184 unq 1 iso 0 dist 7.95111 8.82012 9.15417 6.30834 6.21206 5.72305 10.8463 6.47974 13.8822 8.77887 numMergedOcc 0
19 mol 188 unq 0 iso 0 dist 8.61217 5.86754 6.90541 7.60757 7.48284 5.48276 15.7955 12.0548 13.353 8.57261 numMergedOcc 0
20 mol 188 unq 1 iso 0 dist 9.56587 8.38962 6.90541 13.4214 7.48284 5.48276 20.1361 12.0548 13.353 8.57261 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 12.9169 8.66809 6.03031 8.44861 numMergedOcc 0
22 mol 205 unq 1 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 6.15806 6.23291 7.26832 5.60393 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 5.77917 7.05305 7.46831 6.23657 5.10114 5.63388 11.3827 6.67959 8.85478 6.38157 numMergedOcc 0
24 mol 214 unq 1 iso 0 dist 5.77917 6.33863 8.60247 6.23657 5.10114 6.214 11.3827 6.67959 11.9355 6.38157 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 8.5166 9.78463 7.39747 5.71442 7.18771 5.66732 8.7017 10.0774 13.6473 8.67805 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.17225 5.57044 9.03492 6.60365 8.32473 5.25615 5.18789 6.17102 8.15665 9.13907 numMergedOcc 0
