0 mol 42 unq 0 iso 0 dist 9.19217 9.82536 7.52257 7.73997 4.12203 4.50835 numMergedOcc 0
1 mol 42 unq 1 iso 0 dist 9.19217 8.77998 4.33061 7.73997 4.12203 4.98339 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 6.34231 8.46313 7.43426 9.02073 3.30756 9.76892 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 7.63855 8.30291 4.44795 6.0827 4.29679 6.8858 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 5.48766 8.30291 4.83921 6.0827 8.07308 6.8858 numMergedOcc 0
5 mol 62 unq 2 iso 0 dist 9.63139 8.30291 6.16158 6.0827 10.3525 6.8858 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.25793 8.14057 11.8136 7.30934 3.79142 10.6242 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 8.23533 7.37255 4.52556 5.52904 4.66066 4.79453 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.96016 9.58693 12.7375 5.61418 6.71463 9.53244 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.96016 9.48388 8.49566 5.61418 6.71463 11.115 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 6.95777 8.26309 5.60443 7.91691 9.06356 7.60664 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 8.44588 9.34456 7.77295 9.27028 3.7042 5.37655 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 9.16474 9.80191 5.89983 6.38269 9.30891 6.54263 numMergedOcc 0
13 mol 113 unq 2 iso 0 dist 9.16474 9.80191 5.89983 7.11196 7.62615 3.92558 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 6.98104 6.97244 6.3368 5.56913 8.97988 4.46691 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 8.56221 6.97244 7.31538 5.56913 3.65999 4.46691 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 5.98732 9.0157 6.45919 5.3865 3.89698 5.57138 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 5.98732 9.14351 8.71871 5.3865 3.89698 10.3504 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.18538 5.27188 6.42688 8.34984 9.06758 5.85692 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 6.14231 8.43682 6.67602 8.26228 7.71002 10.1415 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 6.14231 6.20796 5.7052 8.26228 7.71002 11.5587 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 9.03579 5.71661 9.41638 9.32126 12.1296 8.13925 numMergedOcc 0
22 mol 294 unq 1 iso 0 dist 9.03579 5.71661 9.41638 9.38111 12.718 12.1489 numMergedOcc 0
23 mol 294 unq 2 iso 0 dist 9.03579 5.71661 9.41638 9.14005 13.7631 6.18981 numMergedOcc 0
24 mol 294 unq 3 iso 0 dist 9.03579 8.98536 13.9089 9.32126 12.1296 11.3477 numMergedOcc 0
25 mol 294 unq 4 iso 0 dist 9.03579 8.98536 13.9089 9.38111 12.718 15.8772 numMergedOcc 0
26 mol 294 unq 5 iso 0 dist 9.03579 8.98536 13.9089 9.14005 13.7631 7.45368 numMergedOcc 0
