0 mol 0 unq 0 iso 0 dist 7.37981 7.30381 5.24778 9.98828 7.19621 11.9766 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 9.58976 9.9859 12.4493 6.23988 6.35342 9.57674 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 6.35342 9.57674 12.4493 6.23988 9.58976 9.9859 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 6.72215 8.02892 6.55304 13.1307 8.23909 10.4925 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.59773 5.7405 4.29856 5.42328 6.59893 8.77224 numMergedOcc 0
5 mol 60 unq 0 iso 0 dist 8.82095 9.34193 9.49968 10.9023 5.83937 14.9632 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.62468 9.32664 15.5028 8.0979 5.92705 10.5121 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.72442 9.53327 10.1488 4.4628 9.68526 12.4862 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.02288 9.53327 14.6243 7.64038 9.58544 11.5958 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 6.78459 9.95103 7.16919 10.2399 7.88564 12.0785 numMergedOcc 0
10 mol 108 unq 0 iso 0 dist 7.29462 6.80069 10.1805 6.45014 5.4057 12.2332 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.83619 5.05277 7.11959 15.0214 9.91643 16.5418 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 8.69888 9.27911 15.6247 7.01839 5.08206 13.2069 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 8.69888 8.57607 12.7456 7.01839 5.08206 11.4305 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 6.00053 5.67112 7.16549 8.67658 7.44191 13.2143 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 9.72979 6.69623 11.7977 13.4033 8.31638 15.1666 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 6.97859 6.69623 10.4747 6.09091 9.38127 12.2414 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.75313 6.48885 10.7174 11.6002 6.08709 15.2008 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 6.23882 8.81349 9.2363 6.35724 6.56437 12.3339 numMergedOcc 0
19 mol 224 unq 2 iso 0 dist 6.23882 8.81349 9.2363 13.2305 9.53131 18.722 numMergedOcc 0
20 mol 224 unq 3 iso 0 dist 6.23882 8.81349 9.2363 14.027 9.34636 16.6845 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 7.80446 8.30714 13.0115 10.3541 9.91395 14.6318 numMergedOcc 0
22 mol 274 unq 1 iso 0 dist 9.86142 8.30714 11.5044 12.757 7.79904 9.61642 numMergedOcc 0
23 mol 274 unq 2 iso 0 dist 8.66451 9.02661 6.70925 5.09461 6.00877 9.67276 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 6.47832 6.1268 5.42688 10.3294 9.70907 13.9949 numMergedOcc 0
