0 mol 7 unq 0 iso 0 dist 8.19144 11.1673 9.55056 11.9671 10.789 5.72491 18.6509 14.144 8.0744 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.19144 11.1673 9.55056 17.0751 12.2708 7.88043 18.6509 14.144 8.0744 5.99459 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.19144 8.71528 7.57354 17.0751 12.2708 8.80762 18.6509 14.144 11.7002 5.99459 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.84459 14.7203 9.55056 16.4849 10.789 5.72491 21.079 14.144 8.0744 9.67164 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.84459 14.7203 9.55056 18.161 12.2708 7.88043 21.079 14.144 8.0744 5.99459 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.84459 10.8725 7.57354 18.161 12.2708 8.80762 21.079 14.144 11.7002 5.99459 numMergedOcc 0
6 mol 8 unq 0 iso 0 dist 7.77271 9.91124 9.07858 13.8619 15.4959 6.82379 11.5556 15.5373 8.64248 6.56356 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 6.87582 5.15368 9.9928 9.93482 11.7126 5.72642 11.9343 16.7897 7.27912 7.69765 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 6.87582 5.15368 9.9928 9.93482 11.7126 5.72642 12.0962 12.9982 10.5109 9.42082 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 8.77794 11.9046 9.9928 12.9647 11.7126 5.72642 15.8736 16.7897 7.27912 7.69765 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 8.77794 11.9046 9.9928 12.9647 11.7126 5.72642 7.34308 12.9982 10.5109 9.42082 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 6.16039 7.14836 6.42785 13.6645 8.84655 8.33077 13.1795 10.1252 6.76477 6.93139 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.39643 11.3475 6.28417 15.0423 6.53652 7.72144 21.9889 14.6576 14.4682 8.33439 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.15536 14.8807 7.01126 16.5107 11.1651 7.35824 18.3925 11.9429 5.68406 9.63417 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 9.15536 9.37871 6.58434 16.5107 11.1651 9.17364 18.3925 11.9429 9.31641 9.63417 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 7.95111 6.30834 6.21206 10.8463 6.47974 8.77887 7.10924 10.9394 6.88536 9.90822 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 7.95111 6.30834 6.21206 10.8463 6.47974 8.77887 11.7525 7.59939 6.19242 6.73504 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 9.75763 9.80071 9.79691 15.8199 13.6975 6.60567 18.1302 18.9952 9.48862 7.41662 numMergedOcc 0
18 mol 195 unq 1 iso 0 dist 9.75763 9.80071 9.79691 8.3705 6.08211 7.62942 4.29894 12.3988 8.89297 9.03441 numMergedOcc 0
19 mol 195 unq 2 iso 0 dist 6.52001 11.6678 9.79691 17.0914 13.6975 6.60567 20.4293 18.9952 9.48862 7.41662 numMergedOcc 0
20 mol 195 unq 3 iso 0 dist 6.52001 11.6678 9.79691 11.2572 6.08211 7.62942 13.3387 12.3988 8.89297 9.03441 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 9.99958 7.2193 6.4829 11.7997 10.9823 7.63018 4.61281 11.516 6.75621 8.63693 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 5.57537 5.20757 6.4829 12.598 10.9823 7.63018 10.3044 11.516 6.75621 8.63693 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 5.77917 6.23657 5.10114 11.3827 6.67959 6.38157 10.7932 8.70987 5.73082 7.46481 numMergedOcc 0
