0 mol 4 unq 0 iso 0 dist 7.1916 9.03342 6.05231 12.657 6.1326 9.80438 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 7.33632 7.5037 9.60039 13.186 14.6347 7.6974 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 8.58504 11.6302 7.28161 12.4588 4.5216 5.48163 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 8.58504 5.27016 4.98783 4.96173 7.64986 7.29864 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 8.58504 5.27016 4.98783 12.4588 4.5216 7.7399 numMergedOcc 0
5 mol 92 unq 3 iso 0 dist 5.94598 11.9997 7.28161 10.4406 4.5216 5.48163 numMergedOcc 0
6 mol 92 unq 4 iso 0 dist 5.94598 6.39099 4.98783 4.55309 7.64986 7.29864 numMergedOcc 0
7 mol 92 unq 5 iso 0 dist 5.94598 6.39099 4.98783 10.4406 4.5216 7.7399 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 7.35799 5.08735 8.51507 9.86241 5.28688 8.24233 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 8.98167 10.9338 9.90594 9.0001 4.36262 8.83822 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 6.74094 9.2673 9.90594 4.7751 4.36262 8.83822 numMergedOcc 0
11 mol 128 unq 0 iso 0 dist 7.44771 3.56535 9.74232 4.26814 5.13616 5.38983 numMergedOcc 0
12 mol 128 unq 1 iso 0 dist 9.74069 10.7105 9.74232 7.66528 5.13616 5.38983 numMergedOcc 0
13 mol 128 unq 2 iso 0 dist 9.27789 11.6561 9.74232 9.40919 5.13616 5.38983 numMergedOcc 0
14 mol 180 unq 0 iso 0 dist 9.85529 4.10999 9.26812 5.70326 8.6624 6.91244 numMergedOcc 0
15 mol 180 unq 1 iso 0 dist 8.6127 13.4464 9.26812 16.2126 8.6624 6.91244 numMergedOcc 0
16 mol 185 unq 0 iso 0 dist 9.53925 6.96484 7.55408 14.5845 9.67128 8.07469 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 8.69185 9.30964 6.23198 4.54064 5.76999 7.88108 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 8.69185 9.30964 6.23198 11.0968 12.9904 9.46576 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 9.20713 7.72208 7.98588 8.95073 3.46565 8.19757 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 8.00749 4.7967 9.2899 5.80835 3.77627 8.85506 numMergedOcc 0
