0 mol 26 unq 0 iso 0 dist 8.11402 3.99573 8.82012 12.8104 9.25649 15.2834 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.11402 3.99573 8.82012 10.8584 9.36104 14.0729 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.11402 14.3932 9.16962 12.8104 9.25649 17.7956 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.11402 14.3932 9.16962 10.8584 9.36104 15.23 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 5.42653 11.3925 8.39016 10.7366 7.54496 8.89062 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 5.42653 5.52097 6.99355 10.7366 7.54496 10.1287 numMergedOcc 0
6 mol 90 unq 2 iso 0 dist 8.71991 13.8549 8.39016 7.4595 7.54496 8.89062 numMergedOcc 0
7 mol 90 unq 3 iso 0 dist 8.71991 10.226 6.99355 7.4595 7.54496 10.1287 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.87854 10.7944 7.39889 7.79265 9.05798 4.91594 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.87854 10.7944 7.39889 11.822 5.85818 9.3046 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 9.87854 16.5599 9.63176 7.79265 9.05798 12.7179 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 9.87854 16.5599 9.63176 11.822 5.85818 4.91132 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 9.87854 5.72463 7.44174 7.79265 9.05798 9.15779 numMergedOcc 0
13 mol 119 unq 5 iso 0 dist 9.87854 5.72463 7.44174 11.822 5.85818 7.61939 numMergedOcc 0
14 mol 119 unq 6 iso 0 dist 8.15125 5.78487 6.19042 13.0339 9.87025 7.61939 numMergedOcc 0
15 mol 119 unq 7 iso 0 dist 8.15125 13.4592 8.43904 13.0339 9.87025 10.326 numMergedOcc 0
16 mol 140 unq 0 iso 0 dist 6.58792 8.3808 8.19104 6.58506 8.06396 11.5685 numMergedOcc 0
17 mol 140 unq 1 iso 0 dist 6.58792 8.3808 8.19104 12.2348 8.01587 8.83949 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 8.15486 5.64431 8.36822 6.93447 8.53433 7.0057 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 9.69154 17.1306 8.99696 7.56779 9.71865 15.4462 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 9.49122 15.7335 8.99696 12.7747 9.71865 15.4462 numMergedOcc 0
21 mol 198 unq 0 iso 0 dist 7.48163 5.80113 7.21533 4.75457 8.16598 6.74772 numMergedOcc 0
22 mol 198 unq 1 iso 0 dist 9.83627 6.34888 7.21533 10.3663 8.16598 6.74772 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 6.74861 6.75833 7.46831 8.62938 5.10114 5.63388 numMergedOcc 0
24 mol 214 unq 1 iso 0 dist 6.74861 14.183 8.60247 8.62938 5.10114 6.214 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 6.54661 10.4397 5.38637 6.12311 8.6597 11.1167 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 6.54661 10.1821 6.55759 6.12311 8.6597 7.83352 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 8.97261 11.886 8.96531 6.12311 7.47235 7.69482 numMergedOcc 0
28 mol 238 unq 3 iso 0 dist 8.97261 10.1821 7.02475 6.12311 7.47235 7.83352 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 5.81774 12.3326 9.03492 11.2327 8.32473 5.25615 numMergedOcc 0
