0 mol 10 unq 0 iso 0 dist 7.21183 7.66861 7.5169 4.87139 8.40467 9.2687 12.0349 11.2691 9.38983 16.1377 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 8.54108 9.50033 8.53135 3.97609 8.58191 5.97852 13.5144 5.28538 9.99467 12.6435 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 8.35366 7.794 8.47518 8.76163 5.87258 4.6365 12.9442 6.3575 9.17447 5.11941 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 8.69829 9.3469 8.47518 8.72795 5.87258 4.6365 12.5723 6.3575 9.17447 5.11941 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 5.76869 3.98752 8.32948 5.91159 6.03151 6.28248 9.14996 7.35107 8.18251 7.57749 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 5.76869 7.08886 7.43338 5.91159 6.03151 3.66253 9.14996 7.35107 5.02642 7.57749 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 7.36255 4.20743 9.44388 7.3395 5.62688 10.5328 9.49487 4.58417 9.94756 10.1246 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 9.75562 5.88863 4.59484 8.2542 8.09699 5.35456 14.3333 7.47696 9.1056 12.263 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 5.83646 5.64173 7.75366 3.72761 5.41453 4.70535 7.82564 5.12308 5.83514 6.96382 numMergedOcc 0
9 mol 247 unq 0 iso 0 dist 7.85081 8.17977 8.64941 7.1875 5.52484 3.42642 8.67304 8.53302 9.21409 9.01651 numMergedOcc 0
10 mol 247 unq 1 iso 0 dist 7.85081 8.17977 8.64941 7.1875 5.52484 3.42642 13.8661 9.26852 9.17812 8.83903 numMergedOcc 0
11 mol 276 unq 0 iso 0 dist 9.51947 5.20175 5.54217 9.32378 9.53331 5.97699 10.605 6.22718 9.51555 14.123 numMergedOcc 0
12 mol 276 unq 1 iso 0 dist 8.9021 4.13451 5.54217 5.54089 9.53331 5.97699 11.3633 6.22718 9.51555 14.123 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 9.69083 14.2956 6.93798 12.9436 8.39635 5.55396 16.7494 7.50871 5.90728 8.4275 numMergedOcc 0
14 mol 283 unq 1 iso 0 dist 5.96202 4.01355 6.93798 3.77125 8.39635 5.55396 8.36393 7.50871 5.90728 8.4275 numMergedOcc 0
15 mol 283 unq 2 iso 0 dist 9.55068 9.29592 6.93798 11.2772 8.39635 5.55396 14.2718 7.50871 5.90728 8.4275 numMergedOcc 0
