0 mol 7 unq 0 iso 0 dist 6.0323 7.15434 5.70161 7.29541 10.0158 5.72491 13.6482 12.6104 7.12508 8.15894 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.53564 9.17086 10.323 8.33667 15.1191 9.93832 13.0289 18.3387 10.8828 7.24352 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 7.26463 8.88255 9.35307 6.89245 12.4974 7.77116 6.88175 4.80926 6.9194 9.6121 numMergedOcc 0
3 mol 119 unq 1 iso 0 dist 7.26463 8.88255 9.35307 6.89245 12.4974 7.77116 14.8889 17.1364 9.68677 9.57341 numMergedOcc 0
4 mol 140 unq 0 iso 0 dist 9.74209 7.83582 12.1389 11.3235 14.6388 5.39064 12.2398 13.8626 4.91618 7.19291 numMergedOcc 0
5 mol 140 unq 1 iso 0 dist 9.74209 7.83582 12.1389 11.3235 14.6388 5.39064 11.2557 16.8568 4.75859 6.66504 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.51265 7.34465 13.1327 7.97183 11.4006 6.69515 13.7901 14.9912 13.2918 6.77921 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 8.51265 9.47675 10.4653 7.97183 11.4006 7.86572 13.7901 14.9912 13.4066 6.77921 numMergedOcc 0
8 mol 212 unq 0 iso 0 dist 6.41916 9.47932 9.7586 14.3725 13.6617 6.29767 13.1493 13.6222 3.9436 5.50658 numMergedOcc 0
9 mol 212 unq 1 iso 0 dist 6.41916 9.47932 9.7586 11.0448 14.7241 8.74585 13.1493 13.6222 3.9436 9.22129 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 7.10689 8.7419 8.81265 7.26742 12.5498 7.862 11.2674 15.1289 8.84507 7.97027 numMergedOcc 0
11 mol 222 unq 1 iso 0 dist 7.10689 8.7419 8.81265 7.26742 12.5498 7.862 12.7466 15.5283 8.67203 6.81955 numMergedOcc 0
12 mol 222 unq 2 iso 0 dist 7.10689 8.7419 8.81265 7.26742 12.5498 7.862 10.656 13.6078 6.02502 4.9876 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 8.14937 14.5658 5.87815 13.4351 15.7308 5.73883 9.71916 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 5.00735 5.62804 7.07028 10.1088 10.3524 6.41286 14.0318 11.9323 9.70574 7.07833 numMergedOcc 0
15 mol 230 unq 1 iso 0 dist 6.73755 5.62804 5.26217 10.1088 10.4504 6.41286 14.0318 10.6719 9.70574 7.07833 numMergedOcc 0
16 mol 251 unq 0 iso 0 dist 8.84041 7.54763 6.07836 8.51564 11.9159 8.01198 7.95984 6.02024 4.86046 6.42747 numMergedOcc 0
