0 mol 21 unq 0 iso 0 dist 6.55346 11.6695 9.28834 16.6515 11.5838 7.81429 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 7.75449 5.33828 8.54392 9.91056 12.0349 5.61656 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 7.75449 5.33828 8.54392 12.8411 11.7635 8.67487 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 7.75449 5.33828 8.54392 8.37503 9.86672 6.95343 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.36759 10.5408 5.97298 15.7133 8.42544 8.92291 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 9.36759 10.5408 5.97298 10.9455 6.09486 6.79185 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 9.36759 10.5408 5.97298 13.4358 4.40385 8.37962 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 5.0553 6.71212 5.97298 12.9917 8.42544 8.92291 numMergedOcc 0
8 mol 43 unq 4 iso 0 dist 5.0553 6.71212 5.97298 10.2065 6.09486 6.79185 numMergedOcc 0
9 mol 43 unq 5 iso 0 dist 5.0553 6.71212 5.97298 9.08164 4.40385 8.37962 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 9.01984 9.20979 5.12572 14.3638 5.8585 8.51098 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 9.76134 7.56371 5.73063 12.0942 4.38244 8.57673 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 8.9675 14.5798 7.43 12.7546 4.66975 7.74216 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 7.4819 6.0215 8.51679 7.15418 4.06625 6.36868 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 7.55125 8.44407 7.95081 9.27989 11.1638 5.45139 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 7.55125 8.44407 7.95081 12.4164 6.08056 8.10769 numMergedOcc 0
16 mol 245 unq 0 iso 0 dist 9.99553 9.18706 6.81738 14.6948 5.13938 8.49651 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 7.15389 5.5176 8.67308 8.40961 4.83983 8.65577 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 7.70759 14.2821 8.67308 12.1637 4.83983 8.65577 numMergedOcc 0
