0 mol 20 unq 0 iso 0 dist 6.93199 6.09002 4.49303 7.06175 5.9809 7.99756 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 6.93199 6.09002 4.49303 3.79581 5.83917 4.36087 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.73162 7.98005 8.62111 7.11305 9.96121 8.97754 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 8.68559 8.91596 4.84198 10.7345 7.11053 8.78511 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.40841 8.34191 3.8375 6.18181 9.76925 9.86895 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 8.63333 9.23438 4.43437 13.5805 10.1478 9.10675 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 8.89374 7.17488 4.43437 10.0669 10.1478 9.10675 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 6.46761 6.79356 4.43437 4.00553 10.1478 9.10675 numMergedOcc 0
8 mol 58 unq 4 iso 0 dist 7.58407 6.79356 9.59066 4.00553 10.7327 9.10675 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 7.13087 8.62079 15.7104 5.9144 12.8714 4.27766 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 7.87814 5.25027 9.64347 5.80367 12.0944 7.92114 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 7.87814 5.25027 9.64347 10.1442 13.9623 8.18375 numMergedOcc 0
12 mol 107 unq 0 iso 0 dist 8.40312 9.45682 6.48911 10.1994 11.1727 5.31375 numMergedOcc 0
13 mol 107 unq 1 iso 0 dist 8.40312 9.45682 6.48911 12.9752 10.9755 6.49371 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 7.39889 4.80684 3.71283 6.30721 6.55202 4.55071 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 9.52936 8.22001 12.4034 4.08775 13.0813 7.25623 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 6.47873 9.52922 13.3106 10.0756 12.0979 4.45769 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 6.47873 9.52922 13.3106 16.4082 18.0358 8.99961 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 6.82208 5.1609 3.72064 6.84862 11.8745 8.88902 numMergedOcc 0
19 mol 228 unq 0 iso 0 dist 9.42615 9.25785 5.63283 9.3302 11.3082 8.92379 numMergedOcc 0
20 mol 228 unq 1 iso 0 dist 8.06181 9.25785 3.65229 9.3302 7.84881 8.92379 numMergedOcc 0
21 mol 228 unq 2 iso 0 dist 7.77367 9.01231 3.62742 9.39743 7.86746 9.06403 numMergedOcc 0
22 mol 228 unq 3 iso 0 dist 9.06121 9.01231 5.34726 9.39743 10.9596 9.06403 numMergedOcc 0
23 mol 256 unq 0 iso 0 dist 5.24676 4.80903 3.89364 6.30188 8.94802 7.32564 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 9.02188 8.97531 12.3522 4.74189 11.6498 9.83672 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.41725 4.9764 13.6468 3.97543 12.3265 5.13533 numMergedOcc 0
