0 mol 8 unq 0 iso 0 dist 8.68949 8.89145 13.2274 9.95165 11.3943 12.1308 16.9454 17.529 18.2144 7.12263 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.68949 8.89145 13.2274 9.95165 11.3943 12.1308 8.95363 12.8778 13.7261 5.00267 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 8.68949 6.92865 8.33226 9.95165 11.3943 5.02333 16.9454 17.529 11.8288 7.12263 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 8.68949 6.92865 8.33226 9.95165 11.3943 5.02333 8.95363 12.8778 7.8922 5.00267 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.75001 7.78708 5.18509 8.75332 9.99008 6.62608 4.93362 12.4926 10.2326 7.69625 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 8.75001 7.84393 12.48 8.75332 9.99008 6.49317 4.93362 12.4926 6.36455 7.69625 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 7.69637 6.85331 9.1927 4.61828 5.84111 6.00575 13.674 12.661 10.7114 9.38831 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 6.70095 8.94173 7.7232 8.83047 5.75171 13.3355 8.60221 8.17003 14.3578 4.75776 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 7.43409 8.04926 3.73188 6.78356 8.80788 6.32957 7.66366 13.5515 12.4436 6.91393 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 7.43409 8.04926 3.73188 6.78356 8.80788 6.32957 5.79574 10.2745 10.7765 8.40038 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 8.53914 7.4371 9.09837 7.73993 5.71872 11.8348 4.36531 8.80233 11.3185 5.46988 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 8.53914 7.4371 9.09837 7.73993 5.71872 11.8348 5.02505 8.71813 8.67766 9.92553 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 9.42014 5.81552 6.29923 6.48223 5.9331 3.98564 11.9632 14.467 13.2485 9.74569 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 6.19457 6.01711 6.89436 6.81707 5.04086 5.487 15.0267 13.7355 14.5662 9.75627 numMergedOcc 0
14 mol 240 unq 0 iso 0 dist 7.19218 6.83069 5.36005 9.30056 5.48054 10.6074 8.30926 8.67485 9.47583 9.53915 numMergedOcc 0
15 mol 240 unq 1 iso 0 dist 7.19218 9.30995 4.4564 9.30056 5.48054 9.23135 8.30926 8.67485 8.44909 9.53915 numMergedOcc 0
16 mol 281 unq 0 iso 0 dist 6.58925 9.48968 9.49279 7.86146 7.15594 12.462 6.7978 9.76311 14.2379 4.95189 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 7.74965 8.08993 4.76222 5.68818 5.94174 6.4399 13.0591 12.0535 13.1486 7.97588 numMergedOcc 0
18 mol 284 unq 1 iso 0 dist 7.74965 7.34344 13.4636 5.68818 5.94174 13.016 13.0591 12.0535 20.2479 7.97588 numMergedOcc 0
