0 mol 24 unq 0 iso 0 dist 6.72502 8.09311 9.94429 4.79736 11.2038 7.77964 8.44664 7.6844 3.84336 9.98592 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.90155 4.79873 6.86525 5.63212 12.3361 7.44277 6.16347 11.0508 5.46578 5.20109 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.6492 6.55597 8.89681 6.47509 12.8378 8.07318 7.45383 11.7817 4.98822 5.20109 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.85586 5.5087 5.50891 6.41115 9.28577 8.46627 10.9586 13.8413 12.3893 5.7684 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.85586 6.08682 4.75954 6.41115 9.28577 9.22208 10.9586 13.8413 14.6305 5.7684 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 5.16364 5.61588 5.50891 5.9144 9.28577 8.46627 9.06229 13.8413 12.3893 5.7684 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 5.16364 7.83244 4.75954 5.9144 9.28577 9.22208 9.06229 13.8413 14.6305 5.7684 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 7.11 5.5087 7.50869 6.41115 11.9068 8.46627 10.9586 17.3098 12.3893 5.7684 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 7.11 6.08682 3.6807 6.41115 11.9068 9.22208 10.9586 17.3098 14.6305 5.7684 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.65802 9.33861 10.2518 6.95017 12.4442 8.89015 11.3767 11.2154 3.71113 8.98912 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.65802 9.33861 10.2518 6.95017 12.4442 8.89015 7.52354 5.8102 4.52323 8.93769 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 5.34214 7.07971 6.8409 5.00433 9.78192 9.09348 7.80523 10.8469 5.92927 7.56755 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 8.03372 5.58833 7.06894 6.16616 13.4823 8.25397 4.97175 4.53459 4.28744 9.35533 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 6.69515 8.07097 5.25982 13.2918 6.77921 7.92216 11.0743 5.38571 10.0208 6.65731 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.41611 5.40637 6.16103 4.78563 13.1913 9.29944 7.78652 15.0801 10.0079 5.06564 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 8.41611 5.40637 6.16103 4.78563 13.1913 9.29944 8.91301 15.0315 9.05366 7.5373 numMergedOcc 0
16 mol 143 unq 2 iso 0 dist 7.63338 5.40637 8.4697 4.78563 10.6706 9.29944 7.78652 11.5146 10.0079 5.06564 numMergedOcc 0
17 mol 143 unq 3 iso 0 dist 7.63338 5.40637 8.4697 4.78563 10.6706 9.29944 8.91301 13.434 9.05366 7.5373 numMergedOcc 0
18 mol 143 unq 4 iso 0 dist 9.03707 5.40637 5.41614 4.78563 10.8457 9.29944 7.78652 8.97873 10.0079 5.06564 numMergedOcc 0
19 mol 143 unq 5 iso 0 dist 9.03707 5.40637 5.41614 4.78563 10.8457 9.29944 8.91301 6.29542 9.05366 7.5373 numMergedOcc 0
20 mol 143 unq 6 iso 0 dist 7.25673 5.40637 6.78032 4.78563 8.612 9.29944 7.78652 6.60479 10.0079 5.06564 numMergedOcc 0
21 mol 143 unq 7 iso 0 dist 7.25673 5.40637 6.78032 4.78563 8.612 9.29944 8.91301 7.54337 9.05366 7.5373 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 7.20574 6.61112 8.58039 10.8286 14.6369 8.5672 8.73217 11.8992 4.03697 9.99396 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 6.6561 8.14831 11.2847 6.28241 11.3657 6.46405 13.45 14.3973 7.96454 9.82043 numMergedOcc 0
24 mol 225 unq 1 iso 0 dist 6.6561 8.14831 11.2847 6.28241 11.3657 6.46405 11.7017 13.923 4.45116 8.22922 numMergedOcc 0
