0 mol 7 unq 0 iso 0 dist 7.34604 9.26914 4.57188 17.0702 9.85726 11.0773 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.14422 9.26914 6.09254 12.1468 7.21217 7.10621 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 4.54652 7.54869 11.9881 5.50049 6.59893 9.5589 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 4.54652 7.54869 11.9881 8.42513 9.06005 11.5304 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 4.54652 6.29729 10.3564 5.50049 6.59893 6.83299 numMergedOcc 0
5 mol 54 unq 3 iso 0 dist 4.54652 6.29729 10.3564 8.42513 9.06005 13.4839 numMergedOcc 0
6 mol 54 unq 4 iso 0 dist 7.42848 7.54869 13.9079 5.50049 5.59773 9.5589 numMergedOcc 0
7 mol 54 unq 5 iso 0 dist 7.42848 6.29729 10.4238 5.50049 5.59773 6.83299 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 6.27903 7.00844 6.62193 4.99741 5.83937 6.65595 numMergedOcc 0
9 mol 60 unq 1 iso 0 dist 7.40841 7.00844 5.63638 4.99741 8.82095 6.65595 numMergedOcc 0
10 mol 60 unq 2 iso 0 dist 7.40841 7.00844 5.63638 5.54608 6.27749 8.90863 numMergedOcc 0
11 mol 61 unq 0 iso 0 dist 8.88571 6.97123 5.4671 7.20068 5.92705 6.65721 numMergedOcc 0
12 mol 61 unq 1 iso 0 dist 8.88571 9.532 10.1513 7.20068 5.92705 6.72123 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 7.24945 7.4804 5.26206 5.37685 6.83992 10.0992 numMergedOcc 0
14 mol 94 unq 0 iso 0 dist 9.2775 9.91121 5.81332 4.07853 9.33801 7.89459 numMergedOcc 0
15 mol 110 unq 0 iso 0 dist 9.64651 9.35711 9.01856 15.5969 7.21229 14.5056 numMergedOcc 0
16 mol 110 unq 1 iso 0 dist 9.64651 9.35711 9.01856 13.2146 5.25492 14.1413 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 6.60885 5.05103 6.98664 11.0695 6.86946 11.8322 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 7.42373 9.09856 7.40242 7.87833 9.91643 9.28393 numMergedOcc 0
19 mol 130 unq 1 iso 0 dist 7.42373 9.14697 9.94056 7.87833 9.91643 13.4452 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 9.40268 6.70271 6.80292 13.5216 9.4473 14.0219 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 9.40268 6.2109 11.8155 13.5216 9.4473 18.5928 numMergedOcc 0
22 mol 196 unq 0 iso 0 dist 7.42532 9.99721 13.6059 5.71443 6.76923 12.2168 numMergedOcc 0
23 mol 196 unq 1 iso 0 dist 7.42532 8.95053 11.1298 5.71443 6.76923 13.1575 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 9.71675 9.24777 10.913 10.574 9.5331 17.0526 numMergedOcc 0
25 mol 197 unq 1 iso 0 dist 8.67145 9.24777 8.69245 8.35405 8.64255 11.6759 numMergedOcc 0
26 mol 265 unq 0 iso 0 dist 8.73109 7.27446 15.4199 11.9907 9.72927 18.8774 numMergedOcc 0
27 mol 282 unq 0 iso 0 dist 7.66682 8.99319 5.43514 12.0597 9.63346 13.5481 numMergedOcc 0
