0 mol 18 unq 0 iso 0 dist 7.23594 5.16057 10.8911 5.03451 10.0997 4.10012 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 7.15141 7.77567 4.13966 9.06004 8.39877 6.33349 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 7.15141 7.77567 4.13966 9.34266 5.85188 5.86299 numMergedOcc 0
3 mol 36 unq 0 iso 0 dist 8.05598 7.38433 6.97061 5.58536 9.13772 7.34881 numMergedOcc 0
4 mol 36 unq 1 iso 0 dist 7.34019 9.0321 10.1196 6.6055 8.76585 5.06004 numMergedOcc 0
5 mol 36 unq 2 iso 0 dist 7.34019 8.88147 6.97061 6.6055 8.76585 13.8997 numMergedOcc 0
6 mol 36 unq 3 iso 0 dist 8.43828 9.0321 5.81516 6.6055 8.91922 5.06004 numMergedOcc 0
7 mol 36 unq 4 iso 0 dist 8.43828 8.88147 12.6598 6.6055 8.91922 13.8997 numMergedOcc 0
8 mol 42 unq 0 iso 0 dist 6.14934 9.36981 7.72347 8.03678 4.50835 9.88278 numMergedOcc 0
9 mol 42 unq 1 iso 0 dist 8.04675 9.36981 5.65461 8.03678 4.98339 9.88278 numMergedOcc 0
10 mol 42 unq 2 iso 0 dist 9.82637 6.64897 3.90287 8.7885 12.7112 9.8142 numMergedOcc 0
11 mol 42 unq 3 iso 0 dist 8.64833 6.64897 8.15001 8.7885 4.50835 9.8142 numMergedOcc 0
12 mol 42 unq 4 iso 0 dist 7.06199 5.94284 5.37955 8.98545 3.53534 5.95684 numMergedOcc 0
13 mol 59 unq 0 iso 0 dist 7.67586 7.89524 6.34565 8.90147 9.60641 4.50866 numMergedOcc 0
14 mol 69 unq 0 iso 0 dist 6.27528 7.91401 6.14227 7.07055 5.54818 9.02536 numMergedOcc 0
15 mol 69 unq 1 iso 0 dist 6.27528 8.68643 9.0801 7.07055 5.54818 7.84746 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 7.28711 5.21227 6.76794 8.47126 9.80027 4.52107 numMergedOcc 0
17 mol 123 unq 0 iso 0 dist 8.87148 9.43033 9.43434 9.85144 6.21159 9.94939 numMergedOcc 0
18 mol 123 unq 1 iso 0 dist 9.26057 9.93167 9.43434 6.60464 6.21159 9.94939 numMergedOcc 0
19 mol 136 unq 0 iso 0 dist 6.53519 8.17454 5.63037 7.75661 4.22085 9.12451 numMergedOcc 0
20 mol 136 unq 1 iso 0 dist 6.53519 9.2549 4.14443 7.75661 4.22085 7.79945 numMergedOcc 0
21 mol 148 unq 0 iso 0 dist 9.7168 9.62458 11.3247 7.91749 6.77599 14.6641 numMergedOcc 0
22 mol 148 unq 1 iso 0 dist 7.38138 9.62458 9.61708 7.91749 10.2375 14.6641 numMergedOcc 0
23 mol 150 unq 0 iso 0 dist 9.61132 9.64273 11.3177 7.96309 6.74495 14.7716 numMergedOcc 0
24 mol 150 unq 1 iso 0 dist 7.34423 9.64273 9.72618 7.96309 10.2651 14.7716 numMergedOcc 0
25 mol 192 unq 0 iso 0 dist 9.05666 6.08455 10.375 8.42665 12.1342 3.22102 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 9.54236 9.97008 16.0975 8.54895 12.0416 4.83034 numMergedOcc 0
27 mol 272 unq 1 iso 0 dist 9.54236 5.98984 4.09369 8.54895 12.0416 9.59378 numMergedOcc 0
28 mol 272 unq 2 iso 0 dist 9.54236 4.90884 6.96015 8.54895 12.0416 11.8573 numMergedOcc 0
29 mol 278 unq 0 iso 0 dist 9.58494 6.95272 7.41825 6.01365 11.0149 5.04677 numMergedOcc 0
