0 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 13.6474 8.07937 10.6139 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.42206 7.34549 5.3315 10.1524 9.66602 9.72289 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.66602 9.72289 5.3315 16.8769 8.07937 10.6139 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.66602 9.72289 5.3315 10.1524 6.42206 7.34549 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.60396 8.99509 14.9742 11.2822 7.48969 19.8731 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.60396 8.47617 12.7554 11.2822 7.48969 17.7518 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 8.60396 5.73331 9.56289 11.2822 7.48969 15.1227 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.60396 8.48694 6.44102 11.2822 7.48969 13.2776 numMergedOcc 0
8 mol 43 unq 4 iso 0 dist 7.48969 6.6657 5.16403 11.2822 8.60396 10.7889 numMergedOcc 0
9 mol 55 unq 0 iso 0 dist 7.03751 7.74108 5.39888 12.6714 8.57785 10.7238 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 7.92027 6.56664 4.47138 7.33551 7.64177 10.2072 numMergedOcc 0
11 mol 62 unq 1 iso 0 dist 7.92027 6.56664 4.47138 6.2471 6.08756 7.99003 numMergedOcc 0
12 mol 62 unq 2 iso 0 dist 7.92027 9.58156 10.9596 7.33551 7.64177 14.041 numMergedOcc 0
13 mol 62 unq 3 iso 0 dist 7.92027 9.58156 10.9596 6.2471 6.08756 9.89555 numMergedOcc 0
14 mol 62 unq 4 iso 0 dist 6.08756 7.99003 4.47138 4.48309 7.64177 10.2072 numMergedOcc 0
15 mol 62 unq 5 iso 0 dist 6.08756 7.99003 4.47138 6.2471 7.92027 6.56664 numMergedOcc 0
16 mol 62 unq 6 iso 0 dist 6.08756 9.52036 4.16095 4.48309 7.64177 11.6456 numMergedOcc 0
17 mol 62 unq 7 iso 0 dist 6.08756 9.52036 4.16095 6.2471 7.92027 11.3813 numMergedOcc 0
18 mol 93 unq 0 iso 0 dist 8.84466 9.10877 12.5871 10.1359 8.52947 17.4493 numMergedOcc 0
19 mol 96 unq 0 iso 0 dist 7.57442 6.19867 10.1389 7.60691 9.01153 11.5795 numMergedOcc 0
20 mol 113 unq 0 iso 0 dist 8.28452 8.29529 14.0364 11.2336 8.44004 18.9382 numMergedOcc 0
21 mol 147 unq 0 iso 0 dist 5.70772 9.23551 10.5583 4.38456 5.03663 10.4004 numMergedOcc 0
22 mol 147 unq 1 iso 0 dist 5.70772 9.23551 10.5583 9.65832 8.93916 11.6819 numMergedOcc 0
23 mol 147 unq 2 iso 0 dist 8.93916 7.4653 8.95179 9.65832 5.70772 10.823 numMergedOcc 0
24 mol 147 unq 3 iso 0 dist 8.93916 7.4653 8.95179 5.64998 5.03663 9.02521 numMergedOcc 0
25 mol 147 unq 4 iso 0 dist 8.93916 7.95564 11.4531 9.65832 5.70772 15.1703 numMergedOcc 0
26 mol 147 unq 5 iso 0 dist 8.93916 7.95564 11.4531 5.64998 5.03663 11.6114 numMergedOcc 0
27 mol 152 unq 0 iso 0 dist 8.30966 9.37459 14.6591 7.21824 7.69136 16.5186 numMergedOcc 0
28 mol 152 unq 1 iso 0 dist 8.30966 9.0847 12.2051 7.21824 7.69136 15.4685 numMergedOcc 0
29 mol 152 unq 2 iso 0 dist 8.30966 6.00061 9.67332 7.21824 7.69136 12.219 numMergedOcc 0
30 mol 152 unq 3 iso 0 dist 8.30966 8.33302 6.18791 7.21824 7.69136 11.2663 numMergedOcc 0
31 mol 152 unq 4 iso 0 dist 7.69136 6.31556 5.01633 7.21824 8.30966 10.2418 numMergedOcc 0
32 mol 183 unq 0 iso 0 dist 8.53483 9.09322 7.79648 10.3494 8.58404 15.4744 numMergedOcc 0
33 mol 196 unq 0 iso 0 dist 5.76319 7.84536 4.57882 4.62996 5.30132 7.07723 numMergedOcc 0
34 mol 196 unq 1 iso 0 dist 5.76319 7.84536 4.57882 5.81158 8.36119 10.6609 numMergedOcc 0
35 mol 196 unq 2 iso 0 dist 5.30132 7.07723 4.57882 4.62996 5.76319 7.84536 numMergedOcc 0
36 mol 196 unq 3 iso 0 dist 5.30132 7.07723 4.57882 10.1053 8.36119 10.6609 numMergedOcc 0
37 mol 196 unq 4 iso 0 dist 8.36119 8.69629 6.70722 5.81158 5.76319 10.2561 numMergedOcc 0
38 mol 196 unq 5 iso 0 dist 8.36119 8.69629 6.70722 10.1053 5.30132 11.7823 numMergedOcc 0
39 mol 241 unq 0 iso 0 dist 7.79013 8.18588 7.20238 12.5546 9.33399 14.333 numMergedOcc 0
40 mol 265 unq 0 iso 0 dist 8.09021 6.78702 5.75478 7.24033 6.98451 8.59825 numMergedOcc 0
41 mol 265 unq 1 iso 0 dist 6.98451 8.59825 5.75478 7.24033 8.09021 6.78702 numMergedOcc 0
42 mol 265 unq 2 iso 0 dist 6.98451 7.83102 9.74462 7.24033 8.09021 13.0772 numMergedOcc 0
