0 mol 10 unq 0 iso 0 dist 8.2106 5.05805 6.6345 11.4724 5.62237 8.13471 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.29504 8.75851 5.5461 7.26523 6.92682 8.13471 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 6.70095 8.60221 8.17003 8.83047 5.75171 4.75776 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.70612 5.00872 6.40964 10.4645 9.28233 8.03028 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 7.70612 5.00872 6.40964 12.1599 11.1606 7.39754 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 6.1083 12.7631 8.5972 16.1463 10.7812 8.44437 numMergedOcc 0
6 mol 105 unq 1 iso 0 dist 6.11833 6.99759 7.29506 5.74652 6.50376 8.44437 numMergedOcc 0
7 mol 105 unq 2 iso 0 dist 7.12201 8.04843 7.29506 9.80729 6.50376 8.44437 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 8.53914 4.36531 8.80233 7.73993 5.71872 5.46988 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 8.53914 5.02505 8.71813 7.73993 5.71872 9.92553 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 9.96586 13.9849 8.6792 18.6048 12.783 8.53374 numMergedOcc 0
11 mol 162 unq 1 iso 0 dist 7.30751 7.2417 8.6792 15.1726 12.783 8.53374 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.98755 10.9549 7.89418 19.5373 15.1919 8.5865 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.91838 10.3155 8.16906 16.2381 10.4922 7.23293 numMergedOcc 0
14 mol 240 unq 0 iso 0 dist 7.19218 8.30926 8.67485 9.30056 5.48054 9.53915 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.57274 11.1831 8.35413 15.4813 10.2978 6.47194 numMergedOcc 0
16 mol 281 unq 0 iso 0 dist 6.58925 6.7978 9.76311 7.86146 7.15594 4.95189 numMergedOcc 0
