0 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 5.76037 7.24183 5.41357 10.9916 14.1776 8.6701 7.48046 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 7.24183 5.41357 7.05519 5.76037 7.8986 8.52643 7.48046 14.1776 8.6701 10.9916 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.02854 5.73235 5.22567 10.0928 12.4201 7.48127 5.50078 10.0184 9.50939 11.6853 numMergedOcc 0
3 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 6.69898 10.4317 7.57471 13.3292 14.4582 9.20673 6.90315 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.6874 6.54778 4.84565 8.36743 11.9317 8.57909 5.72803 8.2575 5.87382 4.5348 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.07294 5.79195 5.35551 12.1681 7.50126 9.2759 4.37065 11.2252 8.98028 15.7191 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 9.07294 5.79195 5.35551 9.34083 12.8985 8.76088 4.37065 11.2252 8.98028 13.5318 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 5.12189 9.2759 10.8516 12.1681 14.2037 5.79195 15.7191 18.338 8.98028 4.37065 numMergedOcc 0
8 mol 133 unq 3 iso 0 dist 5.12189 9.2759 10.8516 11.2107 9.428 8.76088 15.7191 18.338 8.98028 13.5318 numMergedOcc 0
9 mol 133 unq 4 iso 0 dist 7.50126 9.2759 5.35551 12.1681 9.07294 5.79195 15.7191 11.2252 8.98028 4.37065 numMergedOcc 0
10 mol 133 unq 5 iso 0 dist 7.50126 9.2759 5.35551 11.2107 12.8985 8.76088 15.7191 11.2252 8.98028 13.5318 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 9.71692 9.18753 11.8278 10.8037 16.0883 8.6953 8.03052 14.9179 9.0735 3.54257 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 9.73708 9.15244 11.6537 10.8647 16.0617 8.65967 8.06512 14.9398 9.03593 3.59609 numMergedOcc 0
13 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 11.6064 18.2835 9.8755 6.22764 4.63353 8.00005 14.2934 numMergedOcc 0
14 mol 165 unq 1 iso 0 dist 8.2197 7.21397 10.5947 8.33453 12.18 8.46714 6.22764 4.63353 8.00005 7.58478 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 5.49559 11.537 9.04741 10.602 14.3695 7.80646 9.49122 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 7.58998 6.23677 6.88745 5.92863 12.3857 7.31608 10.602 14.3695 7.80646 6.23998 numMergedOcc 0
17 mol 224 unq 2 iso 0 dist 8.71944 8.82663 5.45067 10.9623 11.168 7.96226 4.93894 8.32306 5.95109 6.23998 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 9.59937 7.58554 5.94643 7.99748 10.2589 8.26312 10.9079 11.1939 5.4687 10.9985 numMergedOcc 0
19 mol 261 unq 0 iso 0 dist 9.70222 4.85199 10.6318 4.70691 14.3042 6.0437 4.30068 12.8603 7.14871 4.0136 numMergedOcc 0
20 mol 261 unq 1 iso 0 dist 9.70222 4.85199 10.6318 6.43452 9.71882 9.13604 4.30068 12.8603 7.14871 10.2597 numMergedOcc 0
21 mol 261 unq 2 iso 0 dist 9.71882 9.13604 10.6318 9.51335 14.3042 6.0437 10.2597 12.8603 7.14871 4.0136 numMergedOcc 0
22 mol 261 unq 3 iso 0 dist 9.71882 9.13604 10.6318 6.43452 9.70222 4.85199 10.2597 12.8603 7.14871 4.30068 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 11.3688 12.4458 8.15119 14.4215 13.4083 9.07744 5.11865 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 8.61456 5.00258 9.80233 4.79603 13.2778 6.04225 4.4471 11.9006 7.21879 4.01024 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 8.61456 5.00258 9.80233 5.92133 8.41041 8.22117 4.4471 11.9006 7.21879 10.1631 numMergedOcc 0
26 mol 282 unq 2 iso 0 dist 8.61456 9.98886 4.68809 5.92133 8.41041 6.81887 12.5442 13.4825 9.60384 7.00145 numMergedOcc 0
27 mol 282 unq 3 iso 0 dist 8.41041 8.22117 9.80233 9.24679 13.2778 6.04225 10.1631 11.9006 7.21879 4.01024 numMergedOcc 0
28 mol 282 unq 4 iso 0 dist 8.41041 8.22117 9.80233 5.92133 8.61456 5.00258 10.1631 11.9006 7.21879 4.4471 numMergedOcc 0
29 mol 282 unq 5 iso 0 dist 8.41041 6.81887 4.68809 5.92133 8.61456 9.98886 7.00145 13.4825 9.60384 12.5442 numMergedOcc 0
