0 mol 7 unq 0 iso 0 dist 8.33249 9.26914 5.70161 12.1468 12.2471 7.10621 9.14422 10.2796 6.09254 7.21217 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 9.26914 4.57188 12.1468 10.2729 7.10621 9.14422 5.38328 6.09254 7.21217 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 4.54652 7.54869 11.9881 5.50049 6.59893 9.5589 7.42848 5.42328 13.9079 5.59773 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 4.54652 6.29729 10.3564 5.50049 6.59893 6.83299 7.42848 5.42328 10.4238 5.59773 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 7.42848 7.54869 13.9079 5.50049 5.59773 9.5589 4.54652 5.42328 11.9881 6.59893 numMergedOcc 0
5 mol 54 unq 3 iso 0 dist 7.42848 6.29729 10.4238 5.50049 5.59773 6.83299 4.54652 5.42328 10.3564 6.59893 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 6.27903 7.00844 6.62193 4.99741 5.83937 6.65595 7.40841 10.9023 5.63638 8.82095 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 6.27903 7.00844 6.62193 5.54608 10.9217 8.90863 7.40841 10.9023 5.63638 6.27749 numMergedOcc 0
8 mol 60 unq 2 iso 0 dist 7.40841 7.00844 5.63638 4.99741 8.82095 6.65595 6.27903 10.9023 6.62193 5.83937 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 8.88571 6.97123 5.4671 7.20068 5.92705 6.65721 15.7099 8.0979 10.7369 9.62468 numMergedOcc 0
10 mol 61 unq 1 iso 0 dist 8.88571 9.532 10.1513 7.20068 5.92705 6.72123 15.7099 8.0979 11.5608 9.62468 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.42373 9.09856 7.40242 7.87833 9.91643 9.28393 13.6778 15.0214 10.0837 7.83619 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.40268 6.2109 11.8155 12.4997 17.4706 6.80239 11.7344 19.4708 7.96098 6.11955 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 7.72575 6.94119 12.1089 12.4052 17.1425 9.0018 17.8485 22.1431 11.5099 8.69888 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 7.72575 6.94119 12.1089 12.4052 17.1425 9.0018 16.5143 19.9052 12.1783 5.08206 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 9.03103 7.08106 4.62641 5.42209 9.90494 6.18308 11.6455 9.07869 5.82028 9.67457 numMergedOcc 0
16 mol 231 unq 0 iso 0 dist 7.88488 6.52115 9.0084 12.4148 15.5078 7.37839 10.1671 13.5977 5.3251 7.79865 numMergedOcc 0
17 mol 231 unq 1 iso 0 dist 7.88488 6.52115 9.0084 14.0894 17.1148 8.40182 10.1671 13.5977 5.3251 6.14348 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 6.89822 7.9828 6.68041 7.97488 12.6542 8.53687 11.9352 13.2858 7.55268 6.77279 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 6.89822 8.73296 10.1367 6.69309 12.3765 9.18903 11.9352 13.2858 13.9868 9.58006 numMergedOcc 0
