0 mol 30 unq 0 iso 0 dist 9.39028 4.60956 9.40183 9.46088 4.03124 8.25499 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.98862 11.0811 6.19304 15.0388 12.7517 9.46895 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 5.78878 8.34132 6.19304 11.1661 12.7517 9.46895 numMergedOcc 0
3 mol 32 unq 2 iso 0 dist 7.98414 6.40044 6.19304 15.7508 12.7517 9.46895 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.63526 9.84442 5.67362 10.3839 5.04866 7.77128 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.86118 10.281 9.67641 15.0475 10.4188 9.25638 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 5.86118 10.281 9.67641 11.3861 6.56501 8.01856 numMergedOcc 0
7 mol 96 unq 0 iso 0 dist 9.46918 16.3002 9.87414 20.8425 12.8509 8.71026 numMergedOcc 0
8 mol 96 unq 1 iso 0 dist 7.64681 5.98346 9.44292 9.48287 8.80734 7.64192 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 9.58736 5.17567 6.28889 13.0073 9.08423 8.71993 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 6.38654 6.51571 8.52162 6.45589 4.04422 5.77828 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 9.77185 16.6839 8.52162 13.6292 4.04422 5.77828 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 5.50061 5.14928 9.14228 8.92649 9.30696 8.00841 numMergedOcc 0
13 mol 241 unq 1 iso 0 dist 5.50061 9.72985 9.04127 12.6072 9.39021 7.91178 numMergedOcc 0
14 mol 241 unq 2 iso 0 dist 9.08025 10.7582 9.14228 13.9945 9.30696 8.00841 numMergedOcc 0
15 mol 241 unq 3 iso 0 dist 9.08025 8.019 9.04127 14.4025 9.39021 7.91178 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 7.83742 6.0421 7.74534 6.77411 3.89742 7.2154 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 6.95619 5.837 8.18174 10.853 5.09064 9.60309 numMergedOcc 0
