0 mol 5 unq 0 iso 0 dist 5.14917 9.57274 8.88048 6.13766 6.93063 4.29021 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.14917 9.57274 8.88048 7.8254 7.86627 7.05039 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 6.73481 9.50033 7.50258 4.11543 5.94216 11.6887 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 8.41842 10.8869 8.04019 8.68099 7.03174 11.7029 numMergedOcc 0
4 mol 33 unq 1 iso 0 dist 8.41842 10.1727 7.44828 8.68099 7.03174 5.34698 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 9.65672 14.3275 9.11512 3.54604 8.22018 12.8904 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 9.65672 14.3275 9.11512 14.1792 8.31737 14.1477 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 9.1662 3.86843 6.49343 11.253 7.87739 11.0084 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 5.52891 6.87376 5.83719 9.21978 7.34368 4.49551 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 7.16287 4.21327 6.94745 14.2644 9.77766 12.0828 numMergedOcc 0
10 mol 132 unq 1 iso 0 dist 7.16287 4.21327 6.94745 11.846 9.11314 10.2787 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 9.8446 4.08841 6.85551 12.0001 4.46402 8.22717 numMergedOcc 0
12 mol 174 unq 0 iso 0 dist 4.77805 5.75017 7.27146 3.68472 4.97597 9.24028 numMergedOcc 0
13 mol 174 unq 1 iso 0 dist 4.77805 6.92858 6.25798 3.68472 4.97597 8.00637 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.31333 4.43567 9.2254 10.9895 5.84716 14.6234 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 7.55333 6.67537 5.86839 6.87889 9.49617 7.96379 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.55805 4.74145 6.39087 8.78097 8.01243 9.77953 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 8.55805 4.74145 6.39087 16.8623 9.55264 12.8065 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 7.93817 4.73439 7.70472 6.69795 5.50716 3.74434 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 7.93817 9.17097 9.16988 6.69795 5.50716 4.14613 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 9.81689 10.531 7.52632 9.77191 7.29987 6.85532 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 8.77418 4.17196 7.66585 7.36238 9.51324 10.5265 numMergedOcc 0
22 mol 286 unq 0 iso 0 dist 8.97304 5.95493 6.83763 6.58832 9.09717 8.40229 numMergedOcc 0
