0 mol 25 unq 0 iso 0 dist 9.36326 8.64255 7.685 8.26412 7.1845 7.6114 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 9.5209 12.4304 8.68559 12.0665 5.57199 7.26268 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 8.9881 4.5514 8.68559 10.2304 5.57199 7.26268 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 9.31622 9.78246 8.68586 15.2834 8.84224 9.86334 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 9.71513 10.0943 7.79359 16.3984 9.49725 7.90423 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 9.77482 5.17524 6.62561 5.20001 6.95589 6.10127 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 9.77482 10.7342 7.63616 14.6926 5.56883 8.19331 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.02079 6.79537 9.12581 13.0221 5.46642 9.98797 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.6461 4.93029 6.93652 10.7382 4.22522 8.07097 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 7.1093 10.5394 6.93652 4.54218 4.22522 8.07097 numMergedOcc 0
10 mol 141 unq 2 iso 0 dist 7.36421 11.2797 6.93652 8.36316 4.22522 8.07097 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.22583 11.755 7.98142 12.2912 4.48306 6.64173 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.22583 11.755 7.98142 14.976 12.2513 9.01624 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 8.22583 11.755 7.98142 12.82 10.2172 9.55105 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 6.62037 5.49497 7.98142 7.83476 4.48306 6.64173 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 6.62037 5.49497 7.98142 13.3652 12.2513 9.01624 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 6.62037 5.49497 7.98142 12.7598 10.2172 9.55105 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 6.21461 5.49497 7.37327 7.83476 4.88823 6.64173 numMergedOcc 0
18 mol 181 unq 7 iso 0 dist 6.21461 5.49497 7.37327 13.3652 14.8923 9.01624 numMergedOcc 0
19 mol 181 unq 8 iso 0 dist 6.21461 5.49497 7.37327 12.7598 14.2334 9.55105 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 9.70674 12.9245 9.19704 19.2865 13.4094 6.52816 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 8.6925 5.69131 8.45368 5.81317 5.9858 7.94911 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 8.6925 16.447 9.59129 13.5558 4.89372 8.21793 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 8.03194 5.09263 8.53199 12.0371 11.6662 7.33709 numMergedOcc 0
24 mol 220 unq 0 iso 0 dist 5.02756 5.74363 7.82944 8.15661 4.03073 9.35274 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 8.94219 10.0712 5.50387 7.9002 3.92979 8.1945 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 7.79898 11.1685 6.98084 12.1601 4.47008 8.19317 numMergedOcc 0
27 mol 235 unq 1 iso 0 dist 7.79898 11.1685 6.98084 14.6237 7.34601 6.29377 numMergedOcc 0
28 mol 235 unq 2 iso 0 dist 7.79898 13.5816 7.32211 12.1601 4.47008 5.1823 numMergedOcc 0
29 mol 235 unq 3 iso 0 dist 7.79898 13.5816 7.32211 14.6237 7.34601 5.70635 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 6.59305 5.87189 6.55759 13.2221 15.4844 9.12776 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 9.13022 4.67735 7.67322 10.1672 9.75095 9.12776 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 5.68415 9.03495 6.77938 14.1043 8.90322 8.03219 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 5.68415 9.03495 6.77938 11.7827 9.2872 6.9899 numMergedOcc 0
