0 mol 18 unq 0 iso 0 dist 9.4649 8.1366 16.059 8.1133 12.14 10.5092 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.4649 8.1366 16.059 8.44727 12.9864 14.829 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 6.45965 8.1366 12.619 8.1133 10.8265 10.5092 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 6.45965 8.1366 12.619 8.44727 3.91445 14.829 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 9.62492 9.81561 11.6365 8.98326 6.3965 8.26217 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 9.62492 9.88078 14.0866 8.98326 6.3965 9.51548 numMergedOcc 0
6 mol 20 unq 2 iso 0 dist 9.62492 7.53599 14.4699 8.98326 6.3965 10.9502 numMergedOcc 0
7 mol 20 unq 3 iso 0 dist 8.67226 9.81561 3.78294 8.98326 4.76485 8.26217 numMergedOcc 0
8 mol 20 unq 4 iso 0 dist 8.67226 9.88078 6.48654 8.98326 4.76485 9.51548 numMergedOcc 0
9 mol 20 unq 5 iso 0 dist 8.67226 7.53599 8.39164 8.98326 4.76485 10.9502 numMergedOcc 0
10 mol 34 unq 0 iso 0 dist 9.12062 6.20159 10.4051 5.39587 13.3334 11.0471 numMergedOcc 0
11 mol 34 unq 1 iso 0 dist 9.12062 6.20159 10.4051 6.47252 8.73415 3.40337 numMergedOcc 0
12 mol 70 unq 0 iso 0 dist 9.2794 9.54062 10.838 8.63204 11.0976 14.179 numMergedOcc 0
13 mol 70 unq 1 iso 0 dist 9.2794 9.54062 10.838 5.4014 6.92915 9.95452 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 9.75708 6.35752 12.3421 7.10218 6.7906 12.0556 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 9.75708 8.88238 11.0685 7.10218 6.7906 4.3232 numMergedOcc 0
16 mol 108 unq 0 iso 0 dist 9.42467 6.85803 6.62209 9.57959 6.42713 11.1523 numMergedOcc 0
17 mol 108 unq 1 iso 0 dist 9.42467 5.64136 4.3192 9.57959 6.42713 7.29981 numMergedOcc 0
18 mol 154 unq 0 iso 0 dist 9.71025 5.7306 10.3934 8.59532 7.4198 6.11889 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 9.19569 6.58855 5.98157 8.89822 7.0638 9.907 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.51189 8.13982 10.9895 6.04336 9.03587 4.4877 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 9.51189 8.13982 10.9895 9.00537 12.4735 11.4066 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 8.51112 8.77346 8.93396 8.08491 3.58901 8.49747 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 8.95136 6.254 12.6877 9.71147 11.9786 8.55206 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 8.95136 6.254 12.6877 6.32553 10.0544 3.45124 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 8.96064 9.67363 9.49635 7.78879 6.19079 7.62763 numMergedOcc 0
