0 mol 39 unq 0 iso 0 dist 8.4436 6.17708 3.91611 13.0672 8.04708 11.0799 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.27321 6.72469 7.71726 9.73424 7.3797 14.4291 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 4.95459 7.21134 11.1059 6.39837 5.58337 12.9676 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 5.21813 5.91797 3.92737 12.3905 7.43804 7.6935 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 5.21813 6.37954 3.94967 12.3905 7.43804 8.71558 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 4.76028 8.59103 7.14708 5.26707 9.51367 10.3442 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 7.35647 9.47287 10.5637 15.106 9.96946 13.3145 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 5.08086 8.8639 5.75739 11.3977 9.32254 11.6202 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 5.08086 7.32009 5.46083 11.3977 9.32254 9.23566 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.0685 9.16579 6.42554 6.34399 8.89293 13.5356 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 6.0685 8.95209 3.87082 6.34399 8.89293 9.43325 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 6.90717 5.56977 3.91276 10.0847 9.84034 12.5129 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 6.90717 5.56977 3.91276 5.19393 8.07237 8.9694 numMergedOcc 0
13 mol 214 unq 2 iso 0 dist 6.90717 5.56977 3.91276 11.1009 8.95218 8.02723 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 5.02385 9.88022 11.7578 5.00251 7.37358 9.813 numMergedOcc 0
15 mol 279 unq 1 iso 0 dist 5.02385 7.26637 4.05042 5.00251 7.37358 6.63442 numMergedOcc 0
16 mol 279 unq 2 iso 0 dist 5.02385 9.88198 9.85432 5.00251 7.37358 13.9321 numMergedOcc 0
