0 mol 32 unq 0 iso 0 dist 4.31912 4.64437 7.11053 8.35776 4.84198 8.78511 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.23162 4.33564 6.016 7.32472 8.50202 6.52283 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.57908 4.33564 8.38156 7.32472 12.0023 6.52283 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 6.57908 9.79566 7.79336 18.5357 16.3505 9.41098 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.60499 12.858 7.58093 20.1888 14.2778 9.32314 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.22048 15.1001 8.35444 11.8002 3.75088 6.23509 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 4.93077 4.80894 8.35444 4.74574 3.75088 6.23509 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 8.91572 8.91835 9.1062 8.1717 5.27573 9.19512 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.55666 5.37066 5.29949 12.5502 5.46299 9.60127 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 8.45284 8.15848 5.29949 11.336 5.46299 9.60127 numMergedOcc 0
10 mol 113 unq 2 iso 0 dist 7.77845 12.7927 5.29949 7.11196 5.46299 9.60127 numMergedOcc 0
11 mol 113 unq 3 iso 0 dist 9.43828 8.15059 5.29949 14.5675 5.46299 9.60127 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.23448 6.98797 4.26972 11.794 4.48264 5.95801 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 9.23448 6.98797 4.26972 10.3969 12.3921 9.92715 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 5.83972 6.98797 7.54341 11.794 9.42799 5.95801 numMergedOcc 0
15 mol 141 unq 3 iso 0 dist 5.83972 6.98797 7.54341 10.3969 11.3121 9.92715 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 7.29635 14.2324 8.91356 22.7358 16.5061 8.74463 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 8.23463 6.38826 9.59574 9.02494 10.2743 8.74463 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.99897 9.36666 8.59762 13.7037 8.99193 4.93516 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.99897 9.36666 8.59762 13.7037 8.99193 4.93516 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.99897 9.36666 8.59762 13.7037 8.99193 4.93516 numMergedOcc 0
