0 mol 1 unq 0 iso 0 dist 7.21349 7.94669 4.02997 4.93091 8.15672 6.69458 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 9.59131 8.45063 13.911 3.84207 13.2808 7.7727 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.72531 8.05728 9.66389 11.3291 14.4979 7.99434 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.27455 6.64564 6.98616 3.86331 11.3246 9.52717 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 4.67917 5.41134 6.07398 5.96516 9.34271 8.185 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 4.67917 9.23605 11.9466 5.96516 9.34271 6.68153 numMergedOcc 0
6 mol 59 unq 2 iso 0 dist 5.81747 8.61357 6.07398 7.53537 9.34271 8.185 numMergedOcc 0
7 mol 59 unq 3 iso 0 dist 6.88924 5.41134 4.58297 5.96516 10.3635 8.185 numMergedOcc 0
8 mol 59 unq 4 iso 0 dist 6.88924 9.23605 10.8174 5.96516 10.3635 6.68153 numMergedOcc 0
9 mol 59 unq 5 iso 0 dist 6.81975 8.61357 4.58297 7.53537 10.3635 8.185 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 8.71274 8.56386 5.8424 10.941 10.5825 8.40918 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.16999 5.52891 5.88232 4.58529 12.2873 9.64136 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 9.0455 7.13958 5.0466 3.54691 7.84813 4.4077 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 9.0455 7.13958 5.0466 5.56761 12.1544 8.4874 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.12336 4.69402 6.49614 5.56456 8.52036 6.67937 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 8.64946 9.96416 12.9286 8.87194 14.6084 9.35049 numMergedOcc 0
16 mol 163 unq 0 iso 0 dist 7.5447 6.89529 12.8414 5.5479 11.461 9.69093 numMergedOcc 0
17 mol 163 unq 1 iso 0 dist 9.04757 6.89529 13.739 5.5479 11.42 9.69093 numMergedOcc 0
18 mol 183 unq 0 iso 0 dist 8.15747 9.15795 14.2931 6.58331 13.9507 7.80268 numMergedOcc 0
19 mol 183 unq 1 iso 0 dist 8.74903 8.72128 14.2931 5.46887 13.9507 7.80268 numMergedOcc 0
20 mol 183 unq 2 iso 0 dist 5.44125 9.15795 6.11741 6.58331 5.50896 7.80268 numMergedOcc 0
21 mol 183 unq 3 iso 0 dist 7.11505 8.72128 6.11741 5.46887 5.50896 7.80268 numMergedOcc 0
22 mol 185 unq 0 iso 0 dist 9.56016 8.2968 8.77077 5.80135 8.07469 9.61525 numMergedOcc 0
23 mol 185 unq 1 iso 0 dist 7.92501 8.2968 10.4047 5.80135 12.7168 9.61525 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 9.80584 8.86627 4.65303 9.70184 5.05414 5.03588 numMergedOcc 0
25 mol 192 unq 1 iso 0 dist 7.95713 9.10569 4.65303 8.12818 5.05414 5.03588 numMergedOcc 0
26 mol 233 unq 0 iso 0 dist 9.06304 8.20598 4.69192 3.4982 10.4612 8.2484 numMergedOcc 0
27 mol 246 unq 0 iso 0 dist 4.82671 7.63397 9.48524 8.86898 13.526 9.03834 numMergedOcc 0
28 mol 254 unq 0 iso 0 dist 9.03136 5.17988 5.36654 3.67192 9.93669 7.02613 numMergedOcc 0
29 mol 254 unq 1 iso 0 dist 9.03136 5.17988 5.36654 10.2653 13.3211 8.95185 numMergedOcc 0
30 mol 254 unq 2 iso 0 dist 9.03136 8.76115 12.3025 12.9566 19.5744 8.30975 numMergedOcc 0
31 mol 254 unq 3 iso 0 dist 9.03136 8.76115 12.3025 10.5182 18.1385 8.10036 numMergedOcc 0
32 mol 254 unq 4 iso 0 dist 9.03136 8.76115 12.3025 10.2653 13.3211 8.96529 numMergedOcc 0
33 mol 285 unq 0 iso 0 dist 8.12306 5.76796 6.37482 10.1123 5.28731 7.08681 numMergedOcc 0
34 mol 285 unq 1 iso 0 dist 8.12306 5.76796 6.37482 7.01472 10.1649 4.95596 numMergedOcc 0
35 mol 285 unq 2 iso 0 dist 8.12306 5.76796 6.37482 11.0045 11.3128 6.3508 numMergedOcc 0
36 mol 285 unq 3 iso 0 dist 8.12306 5.76796 6.37482 8.2602 14.2549 8.3005 numMergedOcc 0
37 mol 287 unq 0 iso 0 dist 9.39409 6.76192 5.66584 11.7613 6.16127 9.31611 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 9.39409 6.76192 5.66584 11.7613 6.16127 9.31611 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 9.39409 6.76192 5.66584 11.7613 6.16127 9.31611 numMergedOcc 0
40 mol 294 unq 0 iso 0 dist 8.89372 8.55037 8.19972 3.83842 12.0796 9.49562 numMergedOcc 0
41 mol 294 unq 1 iso 0 dist 8.89372 5.71656 10.8049 3.83842 12.0796 8.32582 numMergedOcc 0
