0 mol 9 unq 0 iso 0 dist 8.29595 14.1289 7.38646 11.8626 9.27637 15.8283 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 6.78356 5.81148 9.01516 14.6957 8.63486 14.3481 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 6.78356 8.85692 7.31255 14.6957 8.63486 14.2307 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.91206 14.1204 8.0534 12.3394 8.03303 4.91508 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.67513 15.8898 8.0534 14.4506 8.03303 4.91508 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 6.59253 9.00615 5.50645 8.82267 7.9233 6.88558 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 7.73842 7.22809 6.07991 5.24877 6.34525 9.52181 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.84146 9.96709 7.20629 13.7656 7.77116 4.6251 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 4.83761 11.8195 9.8727 8.39675 8.97264 5.58502 numMergedOcc 0
9 mol 124 unq 1 iso 0 dist 4.83761 11.8195 9.8727 10.3233 8.80896 4.7632 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 7.68174 13.0938 9.31118 13.9162 9.46588 5.50061 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 7.68174 4.63152 8.44104 13.9162 9.46588 13.2671 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 9.17868 8.95659 7.64275 9.72865 9.31851 11.6982 numMergedOcc 0
13 mol 156 unq 1 iso 0 dist 9.17868 8.95659 7.64275 9.85133 6.2319 12.6787 numMergedOcc 0
14 mol 156 unq 2 iso 0 dist 9.17868 8.95659 7.64275 15.9362 9.97732 16.7351 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 4.97005 9.36078 5.31166 11.3961 9.56197 5.95114 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 4.97005 9.36078 5.31166 10.0248 7.24795 5.93294 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 4.97005 9.36078 5.31166 9.14781 8.64409 8.88219 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 4.97005 9.36078 5.31166 6.69897 7.60202 7.74823 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 9.04499 15.0661 7.11989 15.0199 9.2581 6.3985 numMergedOcc 0
20 mol 222 unq 1 iso 0 dist 9.04499 15.0661 7.11989 8.88 9.62632 11.068 numMergedOcc 0
21 mol 222 unq 2 iso 0 dist 9.04499 15.0661 7.11989 5.68063 7.862 12.6853 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 7.11691 11.1133 4.80092 11.9042 9.64269 7.33684 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 7.11691 11.1133 4.80092 9.87214 6.88809 6.40917 numMergedOcc 0
24 mol 272 unq 2 iso 0 dist 7.11691 11.1133 4.80092 5.27123 8.46061 10.4451 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.84798 16.3239 7.84195 13.8061 8.29305 11.4893 numMergedOcc 0
26 mol 279 unq 1 iso 0 dist 8.84798 16.3239 7.84195 7.7504 6.43341 12.9462 numMergedOcc 0
27 mol 279 unq 2 iso 0 dist 8.84798 12.5605 9.2174 13.8061 8.29305 4.98462 numMergedOcc 0
28 mol 279 unq 3 iso 0 dist 8.84798 12.5605 9.2174 7.7504 6.43341 7.30763 numMergedOcc 0
29 mol 282 unq 0 iso 0 dist 6.91282 6.38947 7.44868 11.0508 8.0241 6.00521 numMergedOcc 0
30 mol 282 unq 1 iso 0 dist 5.51953 5.98603 7.44868 7.1564 8.0241 6.00521 numMergedOcc 0
