0 mol 13 unq 0 iso 0 dist 9.06861 8.66515 3.35815 6.6309 11.4536 9.06342 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 7.41968 8.35273 10.1102 7.95079 13.9847 7.324 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 7.41968 8.35273 10.1102 4.79124 10.2253 7.18716 numMergedOcc 0
3 mol 17 unq 2 iso 0 dist 8.7483 8.35273 9.31896 7.95079 11.6846 7.324 numMergedOcc 0
4 mol 17 unq 3 iso 0 dist 8.7483 8.35273 9.31896 4.79124 5.41678 7.18716 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 7.41509 7.52145 3.24351 9.74984 8.5448 5.78231 numMergedOcc 0
6 mol 32 unq 1 iso 0 dist 7.41509 7.52145 3.24351 7.27475 10.8455 9.41538 numMergedOcc 0
7 mol 32 unq 2 iso 0 dist 5.47336 8.35776 9.30168 11.3409 14.2462 5.78231 numMergedOcc 0
8 mol 32 unq 3 iso 0 dist 5.47336 8.35776 9.30168 8.8719 11.1266 9.41538 numMergedOcc 0
9 mol 46 unq 0 iso 0 dist 5.41906 7.12713 8.59614 8.08636 11.8588 5.81662 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 7.09826 5.52904 6.8994 4.03085 9.24651 6.02596 numMergedOcc 0
11 mol 90 unq 1 iso 0 dist 7.09826 5.52904 6.8994 4.99029 4.5401 8.17454 numMergedOcc 0
12 mol 96 unq 0 iso 0 dist 6.26863 7.40983 4.46676 8.67044 10.5672 7.22615 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 9.98863 9.67805 4.15106 6.70623 10.018 8.4285 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 4.42722 7.39043 6.47265 4.61842 7.00531 6.23243 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 5.73488 7.22151 8.58432 4.40718 9.21721 5.65735 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 6.81706 8.50916 3.92859 14.1389 11.247 9.79593 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 9.10682 9.05194 11.3526 14.9602 16.3282 9.05879 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 9.10682 9.05194 11.3526 5.495 6.14231 6.67548 numMergedOcc 0
19 mol 264 unq 2 iso 0 dist 9.10682 9.02526 8.93485 5.495 6.14231 5.57579 numMergedOcc 0
20 mol 264 unq 3 iso 0 dist 7.60952 9.05194 6.26054 14.9602 13.4709 9.05879 numMergedOcc 0
21 mol 264 unq 4 iso 0 dist 7.60952 9.05194 6.26054 5.495 4.68488 6.67548 numMergedOcc 0
22 mol 264 unq 5 iso 0 dist 7.60952 9.02526 3.81537 5.495 4.68488 5.57579 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 6.33388 6.82335 6.48913 11.0879 9.28712 8.81999 numMergedOcc 0
