0 mol 7 unq 0 iso 0 dist 5.72491 8.72114 10.1959 16.4405 17.6947 8.60435 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.92414 7.03958 8.07902 5.7531 12.3159 7.27018 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.82379 7.03958 5.65816 5.7531 7.12263 7.27018 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 7.3915 8.53529 5.65816 8.79272 7.12263 7.27018 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 9.87669 12.419 6.59455 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 9.78006 9.62394 7.28672 11.0722 5.55437 8.076 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 9.78006 9.62394 7.28672 14.814 12.4029 6.32226 numMergedOcc 0
7 mol 9 unq 3 iso 0 dist 7.9944 6.55811 4.58685 11.4245 10.5473 6.59455 numMergedOcc 0
8 mol 9 unq 4 iso 0 dist 7.9944 8.48677 9.06304 11.4245 10.5473 5.71201 numMergedOcc 0
9 mol 9 unq 5 iso 0 dist 7.032 8.64915 4.58685 14.7278 10.5473 6.59455 numMergedOcc 0
10 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 11.1124 15.8538 6.2004 numMergedOcc 0
11 mol 24 unq 1 iso 0 dist 6.72502 8.60554 6.99746 11.2106 9.40479 4.90592 numMergedOcc 0
12 mol 24 unq 2 iso 0 dist 6.72502 8.60554 6.99746 5.97304 9.38831 9.36461 numMergedOcc 0
13 mol 24 unq 3 iso 0 dist 6.72502 9.44691 7.05541 11.2106 9.40479 8.16324 numMergedOcc 0
14 mol 24 unq 4 iso 0 dist 4.93188 6.73939 10.0715 10.2913 14.8246 6.2004 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 8.65802 7.52354 5.8102 7.23437 7.39754 8.29345 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 6.34525 6.84011 8.51024 11.177 12.7405 9.17466 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 7.99857 9.11344 6.96805 4.99056 8.03035 8.8562 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 8.56342 6.52773 6.96805 3.78311 8.03035 8.8562 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 8.56342 9.23858 13.3975 3.78311 8.03035 7.91683 numMergedOcc 0
20 mol 119 unq 3 iso 0 dist 6.37542 6.52773 4.86811 3.78311 7.6968 8.8562 numMergedOcc 0
21 mol 119 unq 4 iso 0 dist 6.37542 9.23858 8.00229 3.78311 7.6968 7.91683 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 9.29384 8.70296 10.8127 7.73656 9.35938 6.48674 numMergedOcc 0
23 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 13.8236 11.3342 7.64956 numMergedOcc 0
24 mol 163 unq 0 iso 0 dist 8.5043 9.69121 4.12188 3.89889 8.23605 7.8639 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 7.71426 5.93786 6.29877 4.44751 7.82546 7.32555 numMergedOcc 0
26 mol 171 unq 1 iso 0 dist 5.10618 8.24693 6.29877 9.61561 7.82546 7.32555 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 5.4969 9.39352 8.94702 4.24624 7.32419 9.71028 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 6.4318 9.39352 4.06277 4.24624 8.31961 9.71028 numMergedOcc 0
29 mol 175 unq 2 iso 0 dist 7.35824 9.39352 10.3786 4.24624 11.3531 9.71028 numMergedOcc 0
30 mol 175 unq 3 iso 0 dist 9.17364 9.39352 11.9672 4.24624 11.7939 9.71028 numMergedOcc 0
31 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 6.66155 5.52678 6.37788 numMergedOcc 0
32 mol 194 unq 1 iso 0 dist 6.26839 8.65535 5.92931 5.4499 9.81666 8.7028 numMergedOcc 0
33 mol 222 unq 0 iso 0 dist 8.48341 9.07471 7.92402 6.42798 12.5422 9.08955 numMergedOcc 0
34 mol 232 unq 0 iso 0 dist 7.83711 9.05071 13.8622 14.8035 17.6303 8.28466 numMergedOcc 0
35 mol 237 unq 0 iso 0 dist 6.50471 9.60163 6.12402 9.59927 7.31113 6.11495 numMergedOcc 0
36 mol 237 unq 1 iso 0 dist 6.50471 9.60163 6.12402 5.12181 9.53139 9.36216 numMergedOcc 0
37 mol 237 unq 2 iso 0 dist 6.50471 9.60163 6.12402 9.52569 11.4278 8.72819 numMergedOcc 0
38 mol 278 unq 0 iso 0 dist 7.67245 6.62841 13.537 5.73336 12.1554 7.21972 numMergedOcc 0
