0 mol 7 unq 0 iso 0 dist 7.34604 5.47645 8.57437 17.0702 9.85726 17.7278 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.43675 13.394 8.57437 10.9739 9.85726 17.7278 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 4.54652 5.41984 5.01162 5.50049 6.59893 9.88291 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 4.54652 5.41984 5.01162 8.42513 9.06005 4.07894 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.88571 5.15272 9.82315 7.20068 5.92705 7.49081 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 8.92623 12.7474 9.67403 13.4485 9.62468 4.90701 numMergedOcc 0
6 mol 61 unq 2 iso 0 dist 8.92623 10.4703 7.28917 13.4485 9.62468 16.7918 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.54374 17.5231 9.78545 11.9722 9.58544 14.2026 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.54374 15.2861 9.97998 11.9722 9.58544 9.27925 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.56824 14.3413 9.79844 6.87973 6.31633 11.8455 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 9.56824 14.3413 9.79844 6.54322 7.21115 15.9176 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 9.64651 11.0512 6.70591 15.5969 7.21229 6.12546 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 9.64651 11.0512 6.70591 13.2146 5.25492 6.39786 numMergedOcc 0
13 mol 110 unq 2 iso 0 dist 9.64651 7.12329 5.43052 15.5969 7.21229 9.24029 numMergedOcc 0
14 mol 110 unq 3 iso 0 dist 9.64651 7.12329 5.43052 13.2146 5.25492 8.50777 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 9.23907 9.27464 5.46716 9.35855 9.61081 9.79072 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 9.23907 9.27464 5.46716 5.23542 5.46922 5.80488 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 9.84306 9.24396 9.92635 15.0235 7.31181 10.0008 numMergedOcc 0
18 mol 183 unq 1 iso 0 dist 9.84306 6.29417 7.85507 15.0235 7.31181 9.95614 numMergedOcc 0
19 mol 185 unq 0 iso 0 dist 8.93886 4.85027 5.40655 10.1499 8.04591 5.77911 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 8.24588 14.038 6.50727 15.5256 9.5331 4.83116 numMergedOcc 0
21 mol 197 unq 1 iso 0 dist 8.24588 15.6343 7.84826 15.5256 9.5331 10.1332 numMergedOcc 0
22 mol 197 unq 2 iso 0 dist 9.71675 6.68028 6.50727 10.574 9.5331 4.83116 numMergedOcc 0
23 mol 197 unq 3 iso 0 dist 9.71675 4.58651 7.84826 10.574 9.5331 10.1332 numMergedOcc 0
24 mol 197 unq 4 iso 0 dist 8.67145 8.64161 5.79753 8.35405 8.64255 13.0113 numMergedOcc 0
25 mol 197 unq 5 iso 0 dist 8.67145 5.68443 7.56537 8.35405 8.64255 4.57437 numMergedOcc 0
26 mol 211 unq 0 iso 0 dist 7.79873 6.83095 7.38723 10.3986 8.63308 3.99353 numMergedOcc 0
27 mol 212 unq 0 iso 0 dist 7.36966 5.50272 9.66798 5.67895 9.53824 8.60368 numMergedOcc 0
28 mol 222 unq 0 iso 0 dist 8.61558 11.1744 6.74371 5.99069 9.93257 10.3288 numMergedOcc 0
29 mol 226 unq 0 iso 0 dist 7.28604 12.9282 8.10096 11.3634 9.5723 5.47434 numMergedOcc 0
30 mol 232 unq 0 iso 0 dist 8.23266 6.26153 6.11539 5.88028 8.68464 5.70808 numMergedOcc 0
31 mol 232 unq 1 iso 0 dist 8.23266 8.73691 9.71082 5.88028 8.68464 4.86949 numMergedOcc 0
32 mol 265 unq 0 iso 0 dist 8.73109 5.20326 8.22353 11.9907 9.72927 7.73011 numMergedOcc 0
