0 mol 10 unq 0 iso 0 dist 6.18431 5.83346 7.14537 7.60549 6.77807 4.68389 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.18431 4.99208 9.39486 7.60549 6.77807 7.73435 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.98592 5.32861 8.69288 8.9018 8.85286 5.69207 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 9.98592 3.84336 7.77964 8.9018 8.85286 5.49307 numMergedOcc 0
4 mol 29 unq 0 iso 0 dist 9.41017 8.16431 5.09702 9.01071 5.99655 3.44035 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.98985 7.71726 5.7369 3.99506 5.64092 3.74917 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 7.98985 7.71726 5.7369 16.2325 8.71074 10.1736 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.7684 12.3893 8.46627 4.1846 4.27766 10.0644 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 5.7684 14.6305 9.22208 4.1846 4.27766 12.1501 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.77077 5.44918 9.08825 3.94039 5.45099 5.16522 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.77077 5.44918 9.08825 5.61505 8.44765 9.60553 numMergedOcc 0
11 mol 76 unq 2 iso 0 dist 8.77077 5.44918 9.08825 8.43884 9.06643 12.9855 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 9.77084 9.51372 8.64934 5.84075 9.04293 5.9297 numMergedOcc 0
13 mol 79 unq 1 iso 0 dist 6.5551 9.51372 8.7515 5.84075 4.78333 5.9297 numMergedOcc 0
14 mol 79 unq 2 iso 0 dist 6.5551 9.51372 8.7515 5.41884 4.74254 11.3271 numMergedOcc 0
15 mol 107 unq 0 iso 0 dist 5.33764 3.79393 6.11492 8.49625 6.49371 5.88785 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 7.83568 15.3699 8.14226 14.5488 6.76852 5.00648 numMergedOcc 0
17 mol 162 unq 0 iso 0 dist 8.33407 4.8427 7.01095 8.40035 8.33649 5.34959 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 7.81263 4.67256 4.61596 5.69882 7.25623 3.30691 numMergedOcc 0
19 mol 184 unq 1 iso 0 dist 7.58375 7.81466 4.61596 4.12242 5.23187 3.74437 numMergedOcc 0
20 mol 198 unq 0 iso 0 dist 8.63279 14.9679 9.91727 5.93733 9.75417 13.1522 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 5.31416 3.94038 8.25329 6.28944 9.59928 4.84709 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 5.44533 3.94038 4.85332 6.28944 7.70062 4.84709 numMergedOcc 0
23 mol 214 unq 2 iso 0 dist 5.44533 3.94038 4.85332 7.23583 7.66702 4.16963 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.43195 6.67077 8.14294 3.98604 8.88902 10.1968 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 8.6233 6.89106 8.1635 4.30125 9.21469 7.72653 numMergedOcc 0
26 mol 292 unq 1 iso 0 dist 8.6233 3.92782 6.22943 4.30125 9.21469 5.36842 numMergedOcc 0
27 mol 292 unq 2 iso 0 dist 8.6233 5.93687 9.23612 4.30125 9.21469 3.08474 numMergedOcc 0
