0 mol 59 unq 0 iso 0 dist 4.67917 5.41134 6.07398 7.14954 5.81747 8.61357 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 5.81747 8.61357 6.07398 7.14954 4.67917 5.41134 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 6.88924 5.41134 4.58297 7.14954 6.81975 8.61357 numMergedOcc 0
3 mol 59 unq 3 iso 0 dist 6.81975 8.61357 4.58297 7.14954 6.88924 5.41134 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 9.44364 7.28815 4.29097 10.3874 10.3956 8.39608 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 9.57953 6.36357 7.3651 7.44304 11.7787 5.52999 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.64946 5.9962 9.5993 11.1037 17.2577 8.61448 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 6.91762 5.16143 7.64573 9.95765 12.165 8.08392 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 7.4839 8.49376 11.6953 3.69868 10.1656 6.9705 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 8.13465 8.49376 11.8339 3.69868 10.9081 6.9705 numMergedOcc 0
10 mol 176 unq 2 iso 0 dist 9.09742 8.49376 6.4738 3.69868 9.94201 6.9705 numMergedOcc 0
11 mol 176 unq 3 iso 0 dist 9.94201 6.9705 6.4738 3.69868 9.09742 8.49376 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 8.15747 9.15795 14.2931 3.75614 8.74903 8.72128 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 8.74903 8.72128 14.2931 3.75614 8.15747 9.15795 numMergedOcc 0
14 mol 183 unq 2 iso 0 dist 5.44125 9.15795 6.11741 3.75614 7.11505 8.72128 numMergedOcc 0
15 mol 183 unq 3 iso 0 dist 7.11505 8.72128 6.11741 3.75614 5.44125 9.15795 numMergedOcc 0
16 mol 185 unq 0 iso 0 dist 7.92501 9.83898 14.5353 12.1865 18.889 7.64068 numMergedOcc 0
17 mol 185 unq 1 iso 0 dist 8.27418 9.83898 9.5349 12.1865 15.4704 7.64068 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 9.80584 8.86627 4.65303 4.45982 7.95713 9.10569 numMergedOcc 0
19 mol 192 unq 1 iso 0 dist 7.95713 9.10569 4.65303 4.45982 9.80584 8.86627 numMergedOcc 0
20 mol 246 unq 0 iso 0 dist 4.82671 7.63397 9.48524 10.2582 13.8518 9.22642 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.37512 9.52903 11.3847 18.0951 20.0022 9.17911 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 5.43053 7.51446 10.3939 6.47501 11.8556 9.36806 numMergedOcc 0
