0 mol 10 unq 0 iso 0 dist 6.6345 9.9373 9.31121 5.62237 8.13471 14.9275 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.6345 7.83087 6.195 5.62237 8.13471 12.3501 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 5.5461 9.6451 10.5189 6.92682 8.13471 14.511 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 5.5461 5.8369 5.92659 6.92682 8.13471 12.1092 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 5.32719 8.51428 5.51163 8.0641 9.72965 14.8363 numMergedOcc 0
5 mol 28 unq 1 iso 0 dist 5.32719 8.51428 5.51163 10.6532 5.63315 7.66985 numMergedOcc 0
6 mol 28 unq 2 iso 0 dist 5.32719 8.51428 5.51163 12.9204 9.8465 14.6279 numMergedOcc 0
7 mol 28 unq 3 iso 0 dist 5.32719 9.28621 6.37119 8.0641 9.72965 13.2403 numMergedOcc 0
8 mol 28 unq 4 iso 0 dist 5.32719 9.28621 6.37119 10.6532 5.63315 9.17482 numMergedOcc 0
9 mol 28 unq 5 iso 0 dist 5.32719 9.28621 6.37119 12.9204 9.8465 10.2134 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 6.40964 9.62106 5.19513 9.28233 8.03028 12.8633 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 6.40964 9.62106 5.19513 11.1606 7.39754 11.5712 numMergedOcc 0
12 mol 93 unq 0 iso 0 dist 8.16531 9.44156 12.4215 4.55916 5.51624 11.0824 numMergedOcc 0
13 mol 93 unq 1 iso 0 dist 8.16531 9.44156 12.4215 15.9068 7.8674 17.3928 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 7.00443 8.76245 14.9051 11.9449 9.14458 20.4873 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 5.14185 8.82481 11.6193 9.27839 9.75627 14.1672 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 7.89418 9.40138 11.8199 15.1919 8.5865 18.8692 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 9.96034 9.84239 7.84639 8.70092 8.5865 14.1536 numMergedOcc 0
18 mol 176 unq 2 iso 0 dist 9.96034 9.1728 11.4731 8.70092 8.5865 15.9117 numMergedOcc 0
19 mol 176 unq 3 iso 0 dist 9.96034 8.0255 12.0573 8.70092 8.5865 14.9075 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.95201 8.35588 14.075 4.89182 7.23293 10.1158 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 5.8679 8.96442 5.46009 11.3148 9.06334 14.0126 numMergedOcc 0
22 mol 237 unq 0 iso 0 dist 6.32364 9.79219 5.15592 12.7836 7.31113 9.61703 numMergedOcc 0
23 mol 237 unq 1 iso 0 dist 6.32364 9.79219 5.15592 12.1471 8.10263 11.5097 numMergedOcc 0
24 mol 237 unq 2 iso 0 dist 6.32364 9.79219 5.15592 6.31546 6.45845 11.445 numMergedOcc 0
25 mol 237 unq 3 iso 0 dist 6.32364 9.79219 5.15592 9.50893 9.53139 12.7319 numMergedOcc 0
26 mol 237 unq 4 iso 0 dist 8.28888 9.79219 6.87635 6.31546 9.11033 11.445 numMergedOcc 0
27 mol 237 unq 5 iso 0 dist 7.61091 9.79219 8.0982 12.7836 9.84466 9.61703 numMergedOcc 0
28 mol 237 unq 6 iso 0 dist 7.61091 9.79219 8.0982 12.1471 6.16557 11.5097 numMergedOcc 0
29 mol 237 unq 7 iso 0 dist 7.61091 9.79219 8.0982 6.31546 5.4813 11.445 numMergedOcc 0
30 mol 260 unq 0 iso 0 dist 7.30709 4.76164 4.05076 4.75467 8.3149 4.64695 numMergedOcc 0
31 mol 281 unq 0 iso 0 dist 9.76311 9.39268 15.8286 7.15594 4.95189 13.2542 numMergedOcc 0
