0 mol 5 unq 0 iso 0 dist 5.2392 4.42081 9.22027 4.9568 3.33561 7.56229 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.44029 6.38154 4.98321 9.90623 5.31713 8.87945 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 8.59739 3.45432 8.51259 10.2786 3.07021 9.21761 numMergedOcc 0
3 mol 168 unq 0 iso 0 dist 8.53936 4.92763 8.32353 10.6876 8.60565 6.53038 numMergedOcc 0
4 mol 184 unq 0 iso 0 dist 8.27396 6.60692 4.61596 9.10344 3.30691 7.25623 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 9.18289 5.33968 5.67168 6.99587 4.97041 6.94594 numMergedOcc 0
6 mol 186 unq 1 iso 0 dist 9.18289 5.33968 5.67168 4.37577 6.50779 5.81881 numMergedOcc 0
7 mol 186 unq 2 iso 0 dist 9.18289 10.9974 5.86483 17.7738 11.366 9.4366 numMergedOcc 0
8 mol 186 unq 3 iso 0 dist 6.26168 3.6848 8.5672 6.99587 5.53349 9.17458 numMergedOcc 0
9 mol 186 unq 4 iso 0 dist 6.26168 3.6848 8.5672 4.37577 4.65666 7.36794 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.41148 6.10058 5.03818 8.93485 6.49396 7.68686 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 5.06713 3.50446 5.03818 5.66636 6.49396 7.68686 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 8.69512 3.50446 6.40171 5.66636 8.93955 7.68686 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.86886 4.91709 8.14294 4.90656 10.1968 8.88902 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 8.7831 3.98113 9.01338 11.3962 8.6503 8.4338 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 9.13546 3.63202 9.78237 12.106 13.7354 8.55386 numMergedOcc 0
16 mol 264 unq 1 iso 0 dist 8.7365 3.63202 9.95798 12.106 14.8609 8.55386 numMergedOcc 0
17 mol 264 unq 2 iso 0 dist 7.19658 13.3131 9.78237 17.3508 13.7354 8.55386 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 7.78796 7.45665 6.22943 9.52066 5.36842 9.21469 numMergedOcc 0
