0 mol 7 unq 0 iso 0 dist 8.8576 5.83293 6.8464 6.68629 7.78327 10.1033 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.13365 8.35576 8.0319 6.09311 7.49157 4.19221 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.13365 8.35576 8.0319 9.56533 7.73794 6.17633 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.34549 8.23892 9.80897 8.82979 7.98005 4.28862 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 7.34549 8.23892 9.80897 3.63999 8.31381 4.93643 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 7.34549 5.19532 8.37225 8.82979 7.98005 5.34503 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 7.34549 5.19532 8.37225 3.63999 8.31381 4.74002 numMergedOcc 0
7 mol 26 unq 4 iso 0 dist 8.09068 14.6126 9.80897 12.3884 7.98005 4.28862 numMergedOcc 0
8 mol 26 unq 5 iso 0 dist 8.09068 14.6126 9.80897 11.7163 8.31381 4.93643 numMergedOcc 0
9 mol 26 unq 6 iso 0 dist 8.09068 9.51004 8.37225 12.3884 7.98005 5.34503 numMergedOcc 0
10 mol 26 unq 7 iso 0 dist 8.09068 9.51004 8.37225 11.7163 8.31381 4.74002 numMergedOcc 0
11 mol 26 unq 8 iso 0 dist 9.72289 17.2928 9.80897 15.7944 7.98005 4.28862 numMergedOcc 0
12 mol 26 unq 9 iso 0 dist 9.72289 17.2928 9.80897 13.5789 8.31381 4.93643 numMergedOcc 0
13 mol 26 unq 10 iso 0 dist 9.72289 12.8246 8.37225 15.7944 7.98005 5.34503 numMergedOcc 0
14 mol 26 unq 11 iso 0 dist 9.72289 12.8246 8.37225 13.5789 8.31381 4.74002 numMergedOcc 0
15 mol 38 unq 0 iso 0 dist 9.70612 13.6797 9.30722 4.46801 7.68478 9.57959 numMergedOcc 0
16 mol 43 unq 0 iso 0 dist 8.47617 11.3388 8.03754 14.2755 9.02471 3.83842 numMergedOcc 0
17 mol 122 unq 0 iso 0 dist 8.054 8.9579 8.75778 10.2953 4.42563 6.39355 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 9.0847 13.0972 8.41774 5.0146 9.00072 15.2106 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 7.14849 12.4035 9.63185 8.84201 4.72821 11.1931 numMergedOcc 0
20 mol 178 unq 1 iso 0 dist 8.63718 7.28647 9.63185 7.09333 4.72821 11.1931 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 6.04106 11.4325 7.51951 3.95968 7.13783 11.1775 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 7.94694 4.45877 8.11407 5.69659 4.51255 3.98316 numMergedOcc 0
23 mol 206 unq 1 iso 0 dist 7.51923 4.45877 8.95375 5.69659 6.23183 3.98316 numMergedOcc 0
24 mol 206 unq 2 iso 0 dist 7.51923 10.6096 9.29007 5.69659 6.23183 13.2719 numMergedOcc 0
25 mol 241 unq 0 iso 0 dist 6.97756 7.46206 7.73213 3.96499 7.52531 9.91137 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 9.64889 10.6345 4.81916 13.4595 4.9764 9.21484 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 9.64889 10.6345 4.81916 13.6295 6.36559 10.3506 numMergedOcc 0
