0 mol 92 unq 0 iso 0 dist 7.38353 9.80904 9.34352 10.3969 7.11127 5.32989 numMergedOcc 0
1 mol 92 unq 1 iso 0 dist 7.38353 9.80904 9.34352 4.65134 6.91655 5.84351 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 4.45006 7.46124 8.42713 11.3276 7.4518 14.7862 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 4.45006 7.46124 8.42713 7.81661 9.1687 9.42916 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.7953 11.3811 9.49192 5.95263 5.78029 7.31891 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 7.92498 9.65776 6.20553 5.60987 5.37302 7.76807 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 8.88867 5.6183 6.4416 5.8344 9.49761 8.06011 numMergedOcc 0
7 mol 128 unq 1 iso 0 dist 8.88867 5.6183 6.4416 10.172 6.03154 5.19611 numMergedOcc 0
8 mol 128 unq 2 iso 0 dist 8.88867 9.00257 7.49024 5.8344 9.49761 6.42135 numMergedOcc 0
9 mol 128 unq 3 iso 0 dist 8.88867 9.00257 7.49024 10.172 6.03154 4.68499 numMergedOcc 0
10 mol 128 unq 4 iso 0 dist 7.04282 5.6183 6.91935 5.8344 9.38436 8.06011 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.58936 8.97693 5.33314 7.01473 8.58172 4.65836 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.58936 8.97693 5.33314 5.11324 8.94585 7.42665 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.26722 11.1226 9.19335 5.5502 5.56565 5.61022 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 6.26722 11.1226 9.19335 5.05981 6.16862 9.07376 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 6.26722 8.01896 8.5076 5.5502 5.56565 5.71483 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 6.26722 8.01896 8.5076 5.05981 6.16862 9.78763 numMergedOcc 0
17 mol 133 unq 4 iso 0 dist 8.78 11.5035 9.19335 9.91819 5.56565 5.61022 numMergedOcc 0
18 mol 133 unq 5 iso 0 dist 8.78 11.5035 9.19335 13.1776 6.16862 9.07376 numMergedOcc 0
19 mol 133 unq 6 iso 0 dist 8.78 6.29102 8.5076 9.91819 5.56565 5.71483 numMergedOcc 0
20 mol 133 unq 7 iso 0 dist 8.78 6.29102 8.5076 13.1776 6.16862 9.78763 numMergedOcc 0
21 mol 163 unq 0 iso 0 dist 9.04436 7.79531 5.80513 3.98078 9.62943 8.55624 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 8.11268 9.51849 6.29631 5.50901 5.51388 7.77054 numMergedOcc 0
23 mol 171 unq 0 iso 0 dist 9.53702 11.9413 7.68295 7.55807 6.80086 9.56885 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 6.81249 10.2035 9.49787 4.69957 6.09838 12.7455 numMergedOcc 0
