0 mol 9 unq 0 iso 0 dist 7.38646 9.50305 8.69493 15.8283 9.27637 11.3237 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.38646 12.11 7.02963 15.8283 9.27637 6.32857 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.0534 16.8772 9.23537 4.91508 8.03303 15.1847 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 5.50645 8.73064 6.13936 6.88558 7.9233 5.77958 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 9.31118 5.28929 8.8359 5.50061 9.46588 9.07346 numMergedOcc 0
5 mol 126 unq 1 iso 0 dist 8.44104 5.95629 8.8359 13.2671 9.46588 9.07346 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.39075 6.74985 4.7699 5.90361 8.56003 7.50998 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 9.40992 16.3111 8.99141 16.4706 9.43259 5.73002 numMergedOcc 0
8 mol 156 unq 1 iso 0 dist 9.40992 6.92071 8.60938 16.4706 9.43259 16.8259 numMergedOcc 0
9 mol 156 unq 2 iso 0 dist 7.44879 8.43964 8.99141 12.6787 9.43259 5.73002 numMergedOcc 0
10 mol 156 unq 3 iso 0 dist 7.44879 14.2642 8.60938 12.6787 9.43259 16.8259 numMergedOcc 0
11 mol 156 unq 4 iso 0 dist 7.64275 8.43964 5.85349 11.6982 9.31851 5.65865 numMergedOcc 0
12 mol 156 unq 5 iso 0 dist 7.64275 8.43964 5.85349 12.6787 6.2319 5.73002 numMergedOcc 0
13 mol 156 unq 6 iso 0 dist 7.64275 8.43964 5.85349 16.7351 9.97732 11.2941 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.27462 6.28201 7.11599 11.7578 7.71426 12.3586 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 6.27462 6.28201 7.11599 5.45834 5.10618 9.45239 numMergedOcc 0
16 mol 171 unq 2 iso 0 dist 6.27462 6.28201 7.11599 11.9898 9.86681 6.08244 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.58421 4.83829 9.51006 5.77884 7.20574 10.568 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 6.58421 4.83829 9.51006 7.02436 6.85302 11.1286 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 5.31166 4.98693 9.05979 5.95114 9.56197 7.10544 numMergedOcc 0
20 mol 186 unq 3 iso 0 dist 5.31166 4.98693 9.05979 5.93294 7.24795 10.591 numMergedOcc 0
21 mol 186 unq 4 iso 0 dist 5.31166 4.98693 9.05979 8.88219 8.64409 8.86145 numMergedOcc 0
22 mol 186 unq 5 iso 0 dist 5.31166 4.98693 9.05979 7.74823 7.60202 10.8899 numMergedOcc 0
23 mol 232 unq 0 iso 0 dist 8.73422 3.4689 6.29118 6.64614 7.83711 4.90814 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 4.80092 7.36167 6.49719 7.33684 9.64269 11.8274 numMergedOcc 0
25 mol 272 unq 1 iso 0 dist 4.80092 7.36167 6.49719 6.40917 6.88809 5.81271 numMergedOcc 0
26 mol 272 unq 2 iso 0 dist 4.80092 7.36167 6.49719 10.4451 8.46061 11.2831 numMergedOcc 0
27 mol 272 unq 3 iso 0 dist 4.80092 9.00526 5.7564 7.33684 9.64269 11.082 numMergedOcc 0
28 mol 272 unq 4 iso 0 dist 4.80092 9.00526 5.7564 6.40917 6.88809 5.82123 numMergedOcc 0
29 mol 272 unq 5 iso 0 dist 4.80092 9.00526 5.7564 10.4451 8.46061 6.72149 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 7.84195 10.8666 7.92537 11.4893 8.29305 13.9298 numMergedOcc 0
31 mol 279 unq 1 iso 0 dist 7.84195 10.8666 7.92537 12.9462 6.43341 9.73122 numMergedOcc 0
32 mol 279 unq 2 iso 0 dist 9.2174 15.9225 7.92537 4.98462 8.29305 13.9298 numMergedOcc 0
33 mol 279 unq 3 iso 0 dist 9.2174 15.9225 7.92537 7.30763 6.43341 9.73122 numMergedOcc 0
