0 mol 17 unq 0 iso 0 dist 9.20038 9.78399 11.1781 9.87179 9.07442 12.171 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 6.76514 6.67704 5.52033 6.93709 8.03182 3.28726 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 7.54441 9.70029 10.3659 8.82943 10.7038 10.7337 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 9.84326 9.70029 5.7332 8.82943 10.1717 10.7337 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 8.41365 9.57335 13.0229 9.63616 10.2702 17.4558 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 8.41365 8.60653 11.0681 9.63616 10.2702 14.2852 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 9.44676 8.7005 9.00182 4.77363 6.76945 6.31214 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 9.44676 8.2802 7.4006 4.77363 6.76945 3.57191 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.16039 6.87196 6.08911 8.12319 9.6361 3.88766 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.7281 5.25309 5.35588 8.07518 4.22401 3.67187 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.7281 5.25309 5.35588 7.39733 7.66761 3.63671 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 7.95111 6.65725 7.4793 9.511 7.71503 4.79971 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 7.95111 6.65725 7.4793 7.72354 4.11581 5.05856 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 8.52642 6.28889 4.17434 6.10013 9.95269 6.18551 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 5.57537 8.78652 5.96222 8.44451 3.82667 5.88175 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 5.57537 9.01437 10.1011 8.44451 3.82667 9.89707 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.45955 8.06003 6.25016 5.04072 5.01453 8.44353 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 8.45955 8.06003 6.25016 8.67956 9.18551 3.95528 numMergedOcc 0
18 mol 220 unq 2 iso 0 dist 7.64168 8.06003 5.65118 5.04072 7.42545 8.44353 numMergedOcc 0
19 mol 220 unq 3 iso 0 dist 7.64168 8.06003 5.65118 8.67956 4.60128 3.95528 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 7.48361 6.8256 9.00137 8.81508 4.46167 8.63927 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.46687 7.10052 6.06723 5.76793 9.55749 5.21917 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 8.46687 7.10052 6.06723 7.72276 6.58695 9.79726 numMergedOcc 0
23 mol 284 unq 0 iso 0 dist 8.6173 5.24993 6.76453 6.61811 10.1727 3.57807 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 7.15795 9.23037 4.39689 8.38399 6.01515 8.78384 numMergedOcc 0
