0 mol 62 unq 0 iso 0 dist 6.35789 7.25138 13.0684 6.13411 12.4451 4.46067 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.73908 5.57551 5.08181 7.27578 5.26566 7.7485 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 6.77421 5.57551 8.41751 7.27578 13.7148 7.7485 numMergedOcc 0
3 mol 101 unq 0 iso 0 dist 7.22737 6.67863 4.4529 9.54415 12.1836 8.19144 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 9.3586 9.48934 15.393 10.5537 18.7833 5.60448 numMergedOcc 0
5 mol 151 unq 0 iso 0 dist 5.62891 6.12972 4.5975 3.96406 9.00461 9.37533 numMergedOcc 0
6 mol 169 unq 0 iso 0 dist 8.18148 7.33643 11.5931 3.89732 11.9885 6.96715 numMergedOcc 0
7 mol 233 unq 0 iso 0 dist 8.20598 7.40498 5.02086 3.4982 8.2484 7.83831 numMergedOcc 0
8 mol 268 unq 0 iso 0 dist 8.43164 8.6577 5.39453 3.43113 7.40323 9.52476 numMergedOcc 0
9 mol 277 unq 0 iso 0 dist 6.70414 5.11998 5.11865 7.31817 4.1545 7.98956 numMergedOcc 0
10 mol 277 unq 1 iso 0 dist 6.70414 5.11998 5.11865 3.91224 4.25172 5.86185 numMergedOcc 0
11 mol 277 unq 2 iso 0 dist 6.70414 5.11998 5.11865 10.8296 11.2914 6.79748 numMergedOcc 0
12 mol 277 unq 3 iso 0 dist 6.70414 5.79925 8.46455 10.8296 11.2914 6.53598 numMergedOcc 0
13 mol 285 unq 0 iso 0 dist 5.76796 6.73396 4.57431 7.01472 4.95596 5.88958 numMergedOcc 0
14 mol 285 unq 1 iso 0 dist 5.76796 6.73396 4.57431 11.0045 6.3508 7.78121 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 6.90956 7.84189 12.0298 9.51119 14.6295 4.68668 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 6.76192 9.40443 13.2202 9.94473 15.6816 6.24487 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 6.90956 7.84189 12.0298 9.51119 14.6295 4.68668 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 6.76192 9.40443 13.2202 9.94473 15.6816 6.24487 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 6.90956 7.84189 12.0298 9.51119 14.6295 4.68668 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 6.76192 9.40443 13.2202 9.94473 15.6816 6.24487 numMergedOcc 0
