0 mol 24 unq 0 iso 0 dist 6.72502 8.44664 7.6844 4.79736 11.2038 9.98592 9.46342 11.6606 5.32861 8.69288 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.72502 8.44664 7.6844 4.79736 11.2038 9.98592 8.09311 9.94429 3.84336 7.77964 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.90155 6.16347 11.0508 5.63212 12.3361 5.20109 11.037 15.8509 4.98822 8.07318 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 6.90155 6.16347 11.0508 5.63212 12.3361 5.20109 4.79873 6.86525 5.46578 7.44277 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 6.6492 7.45383 11.7817 6.47509 12.8378 5.20109 6.55597 8.89681 4.98822 8.07318 numMergedOcc 0
5 mol 25 unq 3 iso 0 dist 6.6492 7.45383 11.7817 6.47509 12.8378 5.20109 12.3944 17.2422 5.46578 7.44277 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.65802 7.52354 5.8102 6.95017 12.4442 8.93769 9.33861 10.2518 4.52323 8.89015 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 5.34214 7.80523 10.8469 5.00433 9.78192 7.56755 7.07971 6.8409 5.92927 9.09348 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 8.03372 4.97175 4.53459 6.16616 13.4823 9.35533 5.58833 7.06894 4.28744 8.25397 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 13.4066 6.77921 6.65731 11.5913 5.25982 10.0208 7.92216 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.41611 7.78652 15.0801 4.78563 13.1913 5.06564 5.40637 6.16103 10.0079 9.29944 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 8.41611 8.91301 15.0315 4.78563 13.1913 7.5373 5.40637 6.16103 9.05366 9.29944 numMergedOcc 0
12 mol 143 unq 2 iso 0 dist 7.63338 7.78652 11.5146 4.78563 10.6706 5.06564 5.40637 8.4697 10.0079 9.29944 numMergedOcc 0
13 mol 143 unq 3 iso 0 dist 7.63338 8.91301 13.434 4.78563 10.6706 7.5373 5.40637 8.4697 9.05366 9.29944 numMergedOcc 0
14 mol 143 unq 4 iso 0 dist 9.03707 7.78652 8.97873 4.78563 10.8457 5.06564 5.40637 5.41614 10.0079 9.29944 numMergedOcc 0
15 mol 143 unq 5 iso 0 dist 9.03707 8.91301 6.29542 4.78563 10.8457 7.5373 5.40637 5.41614 9.05366 9.29944 numMergedOcc 0
16 mol 143 unq 6 iso 0 dist 7.25673 7.78652 6.60479 4.78563 8.612 5.06564 5.40637 6.78032 10.0079 9.29944 numMergedOcc 0
17 mol 143 unq 7 iso 0 dist 7.25673 8.91301 7.54337 4.78563 8.612 7.5373 5.40637 6.78032 9.05366 9.29944 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 8.15099 6.35982 7.29587 4.78249 5.13268 6.47164 10.7199 8.5768 5.04147 8.75024 numMergedOcc 0
19 mol 170 unq 1 iso 0 dist 8.15099 7.51126 8.73585 4.78249 5.13268 9.65126 10.7199 8.5768 10.518 8.75024 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 6.72641 7.76163 6.71237 14.106 10.5765 9.99396 11.651 9.435 4.03697 8.5672 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 7.20574 8.73217 11.8992 10.8286 14.6369 9.99396 6.61112 8.58039 4.03697 8.5672 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 6.60567 7.36683 6.0634 5.41635 6.34234 6.22742 8.9507 10.9712 5.45812 8.22795 numMergedOcc 0
23 mol 195 unq 1 iso 0 dist 7.62942 9.26504 6.0634 6.04871 6.34234 6.22742 12.662 10.9712 5.45812 8.22795 numMergedOcc 0
24 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 5.0317 9.43618 9.18728 11.595 14.9695 8.62578 8.85955 numMergedOcc 0
25 mol 227 unq 1 iso 0 dist 8.03442 7.43071 12.8075 5.0317 9.43618 9.18728 9.91384 11.2819 10.5007 6.09335 numMergedOcc 0
26 mol 227 unq 2 iso 0 dist 8.03442 5.41321 4.59123 5.0317 9.43618 8.91971 11.595 14.9695 15.624 8.85955 numMergedOcc 0
27 mol 227 unq 3 iso 0 dist 8.03442 5.41321 4.59123 5.0317 9.43618 8.91971 9.91384 11.2819 12.8337 6.09335 numMergedOcc 0
