0 mol 69 unq 0 iso 0 dist 7.67696 8.88983 5.45501 4.06151 8.29328 11.4228 10.8259 7.17133 11.0493 9.02053 numMergedOcc 0
1 mol 123 unq 0 iso 0 dist 7.99359 6.36344 9.13867 4.99882 8.56386 7.97266 7.21006 8.40918 11.8291 10.941 numMergedOcc 0
2 mol 131 unq 0 iso 0 dist 8.89564 9.58388 7.49696 4.26345 9.09918 11.8448 5.906 7.75833 12.4002 5.78374 numMergedOcc 0
3 mol 131 unq 1 iso 0 dist 8.89564 6.77889 4.1643 4.26345 9.09918 8.89412 5.906 7.75833 6.94015 5.78374 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.13344 9.18505 5.16554 6.45157 4.69402 8.63817 4.88335 6.67937 9.88156 5.56456 numMergedOcc 0
5 mol 151 unq 0 iso 0 dist 8.15628 8.96469 7.72755 4.20596 5.62891 9.74969 6.07474 9.00461 12.2374 3.96406 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.72113 9.26913 4.96821 7.45659 5.83898 9.01869 4.90099 5.97886 6.92364 3.85596 numMergedOcc 0
7 mol 233 unq 0 iso 0 dist 6.50096 9.99681 8.37757 3.63541 8.20598 11.8093 6.41178 8.2484 12.233 3.4982 numMergedOcc 0
8 mol 233 unq 1 iso 0 dist 9.91416 9.89626 8.37757 6.30963 8.20598 11.8093 9.33444 8.2484 12.233 3.4982 numMergedOcc 0
9 mol 253 unq 0 iso 0 dist 8.2681 8.08789 9.02376 4.69007 8.32005 10.3193 6.93425 6.74521 12.8629 7.03949 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 4.12505 9.31611 9.7875 11.7613 numMergedOcc 0
11 mol 288 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 4.12505 9.31611 9.7875 11.7613 numMergedOcc 0
12 mol 289 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 4.12505 9.31611 9.7875 11.7613 numMergedOcc 0
13 mol 294 unq 0 iso 0 dist 9.23009 6.6112 6.79888 9.32276 5.71656 10.7501 10.0567 8.32582 12.3208 3.83842 numMergedOcc 0
14 mol 294 unq 1 iso 0 dist 9.23009 8.34193 12.8482 9.32276 5.71656 15.4564 10.0567 8.32582 17.4756 3.83842 numMergedOcc 0
15 mol 294 unq 2 iso 0 dist 9.23009 8.35722 7.05161 9.32276 5.71656 5.27236 10.0567 8.32582 8.58048 3.83842 numMergedOcc 0
