0 mol 13 unq 0 iso 0 dist 7.42612 6.791 8.27119 13.7946 14.8035 7.98465 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.02753 7.76823 8.11835 13.9014 9.4067 9.35863 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 6.09002 7.06175 7.99756 6.93199 4.49303 5.9809 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 6.09002 3.79581 4.36087 6.93199 4.49303 5.83917 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.98005 7.11305 8.97754 13.2086 7.97596 9.06516 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 7.98005 7.11305 8.97754 6.73162 8.62111 9.96121 numMergedOcc 0
6 mol 32 unq 0 iso 0 dist 8.91596 10.7345 8.78511 8.68559 4.84198 7.11053 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 9.23438 13.5805 9.10675 17.4911 10.5052 8.13051 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 7.17488 10.0669 9.10675 12.7237 10.5052 8.13051 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 6.79356 4.00553 9.10675 10.5905 10.5052 8.13051 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 4.80684 6.30721 4.55071 7.39889 3.71283 6.55202 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 7.60162 10.5082 4.55071 10.5042 3.71283 6.55202 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.09063 5.76063 6.76852 9.30812 5.45 5.73203 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 6.09063 4.63567 4.94473 9.30812 5.45 6.57379 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.64905 7.39837 6.60366 9.93541 4.19541 7.46803 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 7.48734 13.2594 8.21227 14.8653 7.8982 7.06851 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 5.6125 10.7557 8.21227 12.5445 7.8982 7.06851 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.65093 11.6282 9.4366 14.4305 6.54455 7.25339 numMergedOcc 0
18 mol 228 unq 0 iso 0 dist 9.25785 9.3302 8.92379 8.06181 3.65229 7.84881 numMergedOcc 0
19 mol 228 unq 1 iso 0 dist 9.01231 9.39743 9.06403 7.77367 3.62742 7.86746 numMergedOcc 0
