0 mol 34 unq 0 iso 0 dist 6.47252 6.00825 5.55479 13.7985 11.2499 9.36493 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.47252 6.00825 5.55479 12.9746 7.20258 9.0665 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 6.47252 6.00825 5.55479 10.0327 6.48477 7.07773 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.99971 5.93639 5.55714 8.61432 4.38297 7.05964 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.72041 5.95619 9.63348 6.6367 4.9947 7.62814 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.73435 8.83086 9.26417 9.85325 5.36604 5.19407 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 8.59103 11.3918 9.05604 9.70389 9.79375 7.68838 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 8.71812 4.39917 9.17843 8.83566 3.43966 7.70636 numMergedOcc 0
8 mol 116 unq 1 iso 0 dist 8.71812 7.43565 7.31364 8.83566 3.43966 6.82267 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 7.85205 11.3792 8.54233 9.75354 9.7683 8.16392 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 8.09403 9.23342 9.07247 9.98096 8.73 9.511 numMergedOcc 0
11 mol 184 unq 1 iso 0 dist 8.09403 9.23342 9.07247 8.24035 9.71065 7.72354 numMergedOcc 0
12 mol 207 unq 0 iso 0 dist 9.05688 11.3486 9.3 12.8895 5.7657 7.18945 numMergedOcc 0
13 mol 285 unq 0 iso 0 dist 7.12723 14.0493 9.26793 5.93983 3.14843 8.38399 numMergedOcc 0
