0 mol 7 unq 0 iso 0 dist 8.19144 11.1673 9.55056 11.9671 10.789 5.72491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.19144 11.1673 9.55056 17.0751 12.2708 7.88043 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.19144 8.71528 7.57354 17.0751 12.2708 8.80762 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.84459 14.7203 9.55056 16.4849 10.789 5.72491 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.84459 14.7203 9.55056 18.161 12.2708 7.88043 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.84459 10.8725 7.57354 18.161 12.2708 8.80762 numMergedOcc 0
6 mol 8 unq 0 iso 0 dist 7.77271 9.91124 9.07858 13.8619 15.4959 6.82379 numMergedOcc 0
7 mol 8 unq 1 iso 0 dist 7.77271 9.91124 9.07858 12.8381 12.0818 6.24978 numMergedOcc 0
8 mol 8 unq 2 iso 0 dist 7.77271 9.91124 9.07858 11.723 11.4738 9.66439 numMergedOcc 0
9 mol 8 unq 3 iso 0 dist 7.77271 9.91124 9.07858 4.92734 4.85329 7.3915 numMergedOcc 0
10 mol 42 unq 0 iso 0 dist 9.88198 7.15313 6.25866 15.2959 11.1435 9.53458 numMergedOcc 0
11 mol 42 unq 1 iso 0 dist 9.88198 7.15313 6.25866 16.061 9.34878 9.16649 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 6.87582 5.15368 9.9928 9.93482 11.7126 5.72642 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 8.77794 11.9046 9.9928 12.9647 11.7126 5.72642 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 6.16039 7.14836 6.42785 13.6645 8.84655 8.33077 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 6.16039 11.923 6.82089 14.3553 10.3933 9.28592 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 9.39643 11.3475 6.28417 15.0423 6.53652 7.72144 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 9.22228 12.0584 7.04913 13.7939 5.07967 7.73169 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 9.15536 14.8807 7.01126 16.5107 11.1651 7.35824 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 9.15536 9.37871 6.58434 16.5107 11.1651 9.17364 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 7.95111 6.30834 6.21206 10.8463 6.47974 8.77887 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 8.61217 7.60757 7.48284 15.7955 12.0548 8.57261 numMergedOcc 0
22 mol 188 unq 1 iso 0 dist 9.56587 13.4214 7.48284 20.1361 12.0548 8.57261 numMergedOcc 0
23 mol 195 unq 0 iso 0 dist 9.75763 9.80071 9.79691 15.8199 13.6975 6.60567 numMergedOcc 0
24 mol 195 unq 1 iso 0 dist 9.75763 9.80071 9.79691 8.3705 6.08211 7.62942 numMergedOcc 0
25 mol 195 unq 2 iso 0 dist 6.52001 11.6678 9.79691 17.0914 13.6975 6.60567 numMergedOcc 0
26 mol 195 unq 3 iso 0 dist 6.52001 11.6678 9.79691 11.2572 6.08211 7.62942 numMergedOcc 0
27 mol 205 unq 0 iso 0 dist 7.70781 6.37333 5.42696 12.9169 8.66809 8.44861 numMergedOcc 0
28 mol 205 unq 1 iso 0 dist 7.70781 6.37333 5.42696 6.15806 6.23291 5.60393 numMergedOcc 0
29 mol 210 unq 0 iso 0 dist 9.99958 7.2193 6.4829 11.7997 10.9823 7.63018 numMergedOcc 0
30 mol 210 unq 1 iso 0 dist 5.57537 5.20757 6.4829 12.598 10.9823 7.63018 numMergedOcc 0
31 mol 214 unq 0 iso 0 dist 5.77917 6.23657 5.10114 11.3827 6.67959 6.38157 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 8.5166 5.71442 7.18771 8.7017 10.0774 8.67805 numMergedOcc 0
33 mol 294 unq 0 iso 0 dist 9.17225 6.60365 8.32473 5.18789 6.17102 9.13907 numMergedOcc 0
