0 mol 58 unq 0 iso 0 dist 8.52969 11.6772 6.81627 12.9126 8.26899 5.98837 11.7927 7.08557 12.0187 9.33535 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 8.52969 9.0406 7.32874 12.9126 8.26899 4.55117 11.7927 7.08557 10.1508 9.33535 numMergedOcc 0
2 mol 58 unq 2 iso 0 dist 8.52969 4.98107 9.55426 12.9126 8.26899 10.3782 11.7927 7.08557 12.7357 9.33535 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 9.74268 6.95018 9.65964 10.7301 7.92394 6.65811 7.95122 5.22626 10.1773 8.33704 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 5.87387 6.4595 7.5732 6.2394 8.71128 5.80557 6.06543 5.59517 10.1027 7.52743 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 6.06543 5.51609 7.35754 6.2394 7.52743 4.77056 5.87387 5.59517 10.1937 8.71128 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 9.41387 6.54872 9.84395 6.69306 6.62561 11.3679 13.8525 7.22206 16.5575 7.63616 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 9.41387 9.3855 7.90328 6.69306 6.62561 4.91401 13.8525 7.22206 7.83136 7.63616 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.32004 6.92096 9.87172 4.91188 6.19042 6.35763 13.1001 9.22558 10.1813 8.43904 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 8.32004 6.92096 9.87172 7.01214 7.44174 7.36192 13.6623 11.3169 14.5183 7.39889 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 8.32004 6.92096 9.87172 7.01214 7.44174 7.36192 15.0885 12.4603 10.3704 9.63176 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.79448 7.78467 8.14887 11.8721 8.59981 14.9761 17.0957 11.279 19.0925 6.192 numMergedOcc 0
12 mol 127 unq 1 iso 0 dist 9.79448 7.78467 8.14887 11.8721 8.59981 14.9761 15.5056 11.4958 18.4772 7.69308 numMergedOcc 0
13 mol 127 unq 2 iso 0 dist 9.79448 7.78467 8.14887 11.8721 8.59981 14.9761 14.1679 5.55757 12.8743 7.66331 numMergedOcc 0
14 mol 127 unq 3 iso 0 dist 9.79448 7.78467 8.14887 11.5439 7.34519 7.41404 14.1679 5.55757 12.8743 8.58999 numMergedOcc 0
15 mol 127 unq 4 iso 0 dist 9.79448 7.78467 8.14887 11.5439 7.34519 7.41404 15.1012 6.16471 11.3474 6.63981 numMergedOcc 0
16 mol 127 unq 5 iso 0 dist 9.79448 6.02237 9.30299 11.8721 8.59981 14.085 17.0957 11.279 17.6472 6.192 numMergedOcc 0
17 mol 127 unq 6 iso 0 dist 9.79448 6.02237 9.30299 11.8721 8.59981 14.085 15.5056 11.4958 15.0647 7.69308 numMergedOcc 0
18 mol 127 unq 7 iso 0 dist 9.79448 6.02237 9.30299 11.8721 8.59981 14.085 14.1679 5.55757 14.7391 7.66331 numMergedOcc 0
19 mol 127 unq 8 iso 0 dist 9.79448 6.02237 9.30299 11.5439 7.34519 13.1312 14.1679 5.55757 14.7391 8.58999 numMergedOcc 0
20 mol 127 unq 9 iso 0 dist 9.79448 6.02237 9.30299 11.5439 7.34519 13.1312 15.1012 6.16471 14.9565 6.63981 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 9.69757 6.82985 7.12972 12.4356 8.6243 6.19596 12.5659 6.63273 6.85062 6.91348 numMergedOcc 0
22 mol 132 unq 0 iso 0 dist 9.0339 15.9368 7.7059 9.29705 6.03703 9.92344 8.48641 4.35917 11.5751 7.61505 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 6.99089 10.1742 6.54501 15.1358 8.6355 10.1448 15.1189 8.80819 11.9139 8.79571 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 6.99089 10.1742 6.54501 15.1358 8.6355 10.1448 11.6481 5.00817 9.5126 5.42582 numMergedOcc 0
25 mol 134 unq 2 iso 0 dist 6.99089 12.6542 6.49416 15.1358 8.6355 5.41704 15.1189 8.80819 8.94367 8.79571 numMergedOcc 0
26 mol 134 unq 3 iso 0 dist 6.99089 12.6542 6.49416 15.1358 8.6355 5.41704 11.6481 5.00817 6.37586 5.42582 numMergedOcc 0
27 mol 156 unq 0 iso 0 dist 7.80643 6.52984 7.44554 5.58352 9.36805 6.29785 7.39961 5.76755 10.4649 8.47155 numMergedOcc 0
28 mol 156 unq 1 iso 0 dist 7.80643 6.52984 7.44554 5.58352 9.36805 6.29785 10.8849 8.38403 9.83699 7.55203 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 7.13194 9.05069 5.72887 14.751 9.29858 13.069 10.3304 10.1648 12.8711 9.68513 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 7.80166 6.77788 5.72887 12.4266 9.29858 13.069 7.62771 10.1648 12.8711 9.68513 numMergedOcc 0
31 mol 249 unq 0 iso 0 dist 6.42827 8.22485 7.57994 5.63238 8.83735 5.23473 6.93507 8.34718 11.7594 8.96876 numMergedOcc 0
32 mol 249 unq 1 iso 0 dist 6.42827 6.77698 6.18582 5.63238 8.83735 7.38675 6.93507 8.34718 12.2913 8.96876 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 7.22438 10.3544 8.33638 6.68919 6.73206 5.63139 7.66615 5.40809 8.46116 9.09992 numMergedOcc 0
34 mol 272 unq 1 iso 0 dist 7.66615 11.4664 9.97651 6.68919 9.09992 10.841 7.22438 5.40809 13.2494 6.73206 numMergedOcc 0
35 mol 272 unq 2 iso 0 dist 7.66615 10.3544 8.46116 6.68919 9.09992 5.63139 7.22438 5.40809 8.33638 6.73206 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 7.90792 8.93697 6.33524 6.63358 7.32347 6.3384 10.9708 5.39891 8.04483 6.85028 numMergedOcc 0
37 mol 282 unq 1 iso 0 dist 7.90792 8.93697 6.33524 6.63358 7.32347 6.3384 11.2496 10.5372 13.5481 8.3411 numMergedOcc 0
