0 mol 17 unq 0 iso 0 dist 9.54285 10.5494 9.26685 9.81441 7.34681 9.4204 10.6012 4.2802 12.5103 6.64199 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.0009 4.39847 7.8986 6.74022 8.52643 7.05519 14.5094 10.9916 14.1776 8.6701 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 8.91298 4.39847 7.24183 6.74022 5.41357 7.05519 14.5094 7.48046 14.1776 8.6701 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 9.15982 14.0132 9.6874 11.2753 6.54778 4.84565 14.2772 5.72803 8.2575 5.87382 numMergedOcc 0
4 mol 148 unq 0 iso 0 dist 5.86949 6.33907 9.71692 12.2411 9.18753 11.8278 13.4908 8.03052 14.9179 9.0735 numMergedOcc 0
5 mol 148 unq 1 iso 0 dist 6.72591 7.50382 9.71692 6.76353 9.18753 11.8278 7.91749 8.03052 14.9179 9.0735 numMergedOcc 0
6 mol 150 unq 0 iso 0 dist 5.84971 6.43607 9.73708 12.1573 9.15244 11.6537 13.5243 8.06512 14.9398 9.03593 numMergedOcc 0
7 mol 150 unq 1 iso 0 dist 6.80192 7.48524 9.73708 6.65519 9.15244 11.6537 7.96309 8.06512 14.9398 9.03593 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 8.34722 6.26228 7.07348 10.6035 9.96635 10.9312 16.7123 13.4119 14.1102 7.76952 numMergedOcc 0
9 mol 158 unq 1 iso 0 dist 8.34722 6.26228 7.07348 10.6035 9.96635 10.9312 11.6369 12.6695 15.9309 9.98554 numMergedOcc 0
10 mol 160 unq 0 iso 0 dist 5.13415 4.29308 8.87648 4.95728 8.1876 4.70871 10.4229 7.58696 13.059 9.5578 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 3.87901 9.24409 8.2197 8.4352 7.21397 10.5947 8.97737 6.22764 4.63353 8.00005 numMergedOcc 0
12 mol 165 unq 1 iso 0 dist 5.04534 6.58447 8.2197 5.73847 7.21397 10.5947 6.4503 6.22764 4.63353 8.00005 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 6.6514 10.8805 9.82329 8.3419 7.20545 9.97915 9.38939 6.39898 14.9436 7.20131 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 9.67207 8.0557 7.30965 4.64973 6.2016 5.21255 8.42665 9.82858 13.0939 7.97601 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 4.90334 6.42715 7.00683 7.84606 9.52029 8.61406 13.1561 16.0878 16.6657 8.98633 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 6.15396 5.46739 8.61456 5.668 5.00258 9.80233 8.36459 4.4471 11.9006 7.21879 numMergedOcc 0
17 mol 282 unq 1 iso 0 dist 6.15396 5.46739 8.61456 8.54733 9.98886 4.68809 15.0154 12.5442 13.4825 9.60384 numMergedOcc 0
18 mol 282 unq 2 iso 0 dist 9.18964 5.46739 8.41041 5.668 8.22117 9.80233 8.36459 10.1631 11.9006 7.21879 numMergedOcc 0
19 mol 282 unq 3 iso 0 dist 9.18964 5.46739 8.41041 8.54733 6.81887 4.68809 15.0154 7.00145 13.4825 9.60384 numMergedOcc 0
