0 mol 17 unq 0 iso 0 dist 9.38298 5.57445 7.34681 14.3956 9.81441 9.54285 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 5.84559 6.18212 7.34681 13.33 9.81441 9.54285 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.81618 6.91685 8.9056 14.3777 7.97622 9.21945 numMergedOcc 0
3 mol 96 unq 1 iso 0 dist 9.81618 6.91685 8.9056 11.8663 9.81613 5.5851 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 9.907 7.38372 7.66418 11.6252 5.40051 5.72494 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 9.907 9.52982 8.078 11.6252 5.40051 8.70106 numMergedOcc 0
6 mol 103 unq 2 iso 0 dist 8.91952 6.99545 6.56481 10.7257 14.0531 8.70106 numMergedOcc 0
7 mol 104 unq 0 iso 0 dist 5.74478 8.79593 5.71279 8.46326 5.30572 6.14066 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 9.20746 8.4153 6.90966 13.6598 8.77277 9.98108 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 5.92115 10.9159 9.52061 17.4532 14.3839 7.48833 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.32304 8.6975 6.08846 15.5243 8.73734 7.78004 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.32304 8.6975 6.08846 13.9135 7.28525 6.53758 numMergedOcc 0
12 mol 131 unq 2 iso 0 dist 8.32304 13.631 9.19171 15.5243 8.73734 9.43182 numMergedOcc 0
13 mol 131 unq 3 iso 0 dist 8.32304 13.631 9.19171 13.9135 7.28525 5.23223 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 6.71787 4.24969 9.39389 8.49299 9.07803 7.14447 numMergedOcc 0
15 mol 136 unq 0 iso 0 dist 9.91448 4.5433 8.41727 13.2836 6.29723 9.67457 numMergedOcc 0
16 mol 136 unq 1 iso 0 dist 7.827 5.72482 8.41727 9.44126 6.29723 9.67457 numMergedOcc 0
17 mol 174 unq 0 iso 0 dist 9.04832 6.13767 6.25798 12.5186 4.98201 9.14165 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 5.91901 5.1382 6.2016 8.64985 4.64973 9.67207 numMergedOcc 0
19 mol 198 unq 0 iso 0 dist 5.42463 5.73389 9.64195 10.8853 13.2374 5.70288 numMergedOcc 0
20 mol 198 unq 1 iso 0 dist 5.42463 5.73389 9.64195 11.4778 13.8187 6.57198 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 5.8391 13.9511 9.52029 11.3053 7.84606 4.90334 numMergedOcc 0
22 mol 204 unq 1 iso 0 dist 9.92924 19.252 9.52029 17.5954 7.84606 4.90334 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 7.64844 5.58105 7.60807 5.39708 6.40983 8.0652 numMergedOcc 0
