0 mol 16 unq 0 iso 0 dist 6.95078 6.75381 7.30592 5.48497 10.46 8.47315 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 3.90209 9.58693 12.3572 15.6711 16.3038 9.59261 numMergedOcc 0
2 mol 102 unq 0 iso 0 dist 7.58293 5.79411 5.09542 6.82817 7.73836 9.01767 numMergedOcc 0
3 mol 102 unq 1 iso 0 dist 7.58293 5.79411 5.09542 10.6581 10.8539 9.80678 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 5.09285 7.91231 4.24853 12.5962 8.592 7.25166 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 8.98702 6.3982 5.47689 5.93926 10.999 6.7225 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.91629 6.44766 5.29825 9.91056 5.50364 8.97145 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 8.91629 6.44766 5.29825 4.56884 8.7301 6.5874 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 9.8444 9.94587 5.33697 15.1802 14.9437 9.75174 numMergedOcc 0
9 mol 238 unq 1 iso 0 dist 9.73405 9.94587 17.5803 15.1802 20.7406 9.75174 numMergedOcc 0
10 mol 276 unq 0 iso 0 dist 5.16952 6.97104 6.33662 12.6916 12.2138 9.05218 numMergedOcc 0
11 mol 276 unq 1 iso 0 dist 5.04414 8.63281 6.33662 11.5683 12.2138 9.05218 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 9.65416 9.60619 5.31331 6.56932 8.66917 8.13489 numMergedOcc 0
13 mol 294 unq 0 iso 0 dist 9.83069 8.98536 18.0966 10.8231 18.4058 9.37818 numMergedOcc 0
