0 mol 43 unq 0 iso 0 dist 9.16827 12.092 6.20293 20.8715 14.445 9.74445 14.9909 8.13395 8.80331 10.323 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 6.85083 7.35881 7.17396 10.7972 6.34264 6.48625 12.4944 6.05545 9.21998 5.30842 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.99643 8.2572 6.72123 10.0527 11.5608 9.62468 13.6976 6.86346 6.65721 10.7369 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 9.99643 8.2572 6.72123 12.5256 10.1513 5.92705 13.6976 6.86346 6.65721 5.4671 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 9.41387 9.3855 7.90328 13.3052 10.4589 9.85576 13.8525 7.22206 7.83136 14.2649 numMergedOcc 0
5 mol 117 unq 1 iso 0 dist 9.41387 9.3855 7.90328 13.3052 10.4589 9.85576 15.4634 9.3584 7.0603 9.53886 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 7.80643 6.52984 7.44554 8.46837 5.0966 7.30021 12.2418 5.56175 8.94056 5.75141 numMergedOcc 0
7 mol 156 unq 1 iso 0 dist 7.80643 6.52984 7.44554 8.46837 5.0966 7.30021 10.8849 8.38403 9.83699 12.865 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 8.50904 8.09861 9.0018 10.6965 11.5099 8.69888 7.04318 6.2715 5.6234 5.50014 numMergedOcc 0
9 mol 175 unq 1 iso 0 dist 8.50904 8.09861 9.0018 10.6965 11.5099 8.69888 11.9173 8.16421 6.57069 7.39186 numMergedOcc 0
10 mol 175 unq 2 iso 0 dist 8.50904 8.09861 9.0018 12.0647 12.1783 5.08206 7.04318 6.2715 5.6234 7.28617 numMergedOcc 0
11 mol 175 unq 3 iso 0 dist 8.50904 8.09861 9.0018 12.0647 12.1783 5.08206 11.9173 8.16421 6.57069 5.77256 numMergedOcc 0
12 mol 175 unq 4 iso 0 dist 7.04318 8.09861 5.6234 10.6965 5.50014 8.69888 8.50904 6.2715 9.0018 11.5099 numMergedOcc 0
13 mol 175 unq 5 iso 0 dist 7.04318 8.09861 5.6234 10.6965 5.50014 8.69888 11.9173 5.35493 6.57069 7.39186 numMergedOcc 0
14 mol 175 unq 6 iso 0 dist 7.04318 8.09861 5.6234 12.0647 7.28617 5.08206 8.50904 6.2715 9.0018 12.1783 numMergedOcc 0
15 mol 175 unq 7 iso 0 dist 7.04318 8.09861 5.6234 12.0647 7.28617 5.08206 11.9173 5.35493 6.57069 5.77256 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 6.01118 9.73148 6.69288 11.0304 12.2822 8.0974 10.064 5.34677 6.43573 12.4338 numMergedOcc 0
17 mol 178 unq 1 iso 0 dist 6.01118 9.73148 6.69288 11.0304 12.2822 8.0974 16.3874 11.7381 7.17202 13.9722 numMergedOcc 0
18 mol 178 unq 2 iso 0 dist 6.01118 9.73148 6.69288 11.0304 12.2822 8.0974 18.2053 14.0703 8.81551 13.5599 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.93637 14.8074 9.23153 21.6232 14.6296 7.31105 15.9523 10.5449 8.24498 9.52692 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 9.93154 6.78651 9.34734 14.2476 16.2594 9.17826 10.7118 6.99063 7.22101 14.9329 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 9.93154 6.78651 9.34734 14.2476 16.2594 9.17826 13.6059 7.60506 8.65997 13.2783 numMergedOcc 0
22 mol 227 unq 2 iso 0 dist 9.93154 6.78651 9.34734 14.2476 16.2594 9.17826 9.18218 7.43198 7.56888 10.6504 numMergedOcc 0
23 mol 227 unq 3 iso 0 dist 9.93154 6.78651 9.34734 14.2476 16.2594 9.17826 6.18486 9.51866 7.55216 11.4528 numMergedOcc 0
24 mol 227 unq 4 iso 0 dist 9.18218 6.78651 7.56888 14.2476 10.6504 9.17826 9.93154 7.43198 9.34734 16.2594 numMergedOcc 0
25 mol 227 unq 5 iso 0 dist 9.18218 6.78651 7.56888 14.2476 10.6504 9.17826 10.7118 10.8658 7.22101 14.9329 numMergedOcc 0
26 mol 227 unq 6 iso 0 dist 9.18218 6.78651 7.56888 14.2476 10.6504 9.17826 13.6059 9.70012 8.65997 13.2783 numMergedOcc 0
27 mol 227 unq 7 iso 0 dist 9.18218 6.78651 7.56888 14.2476 10.6504 9.17826 6.18486 4.48529 7.55216 11.4528 numMergedOcc 0
28 mol 227 unq 8 iso 0 dist 6.18486 6.78651 7.55216 14.2476 11.4528 9.17826 9.93154 9.51866 9.34734 16.2594 numMergedOcc 0
29 mol 227 unq 9 iso 0 dist 6.18486 6.78651 7.55216 14.2476 11.4528 9.17826 10.7118 12.4689 7.22101 14.9329 numMergedOcc 0
30 mol 227 unq 10 iso 0 dist 6.18486 6.78651 7.55216 14.2476 11.4528 9.17826 13.6059 12.9332 8.65997 13.2783 numMergedOcc 0
31 mol 227 unq 11 iso 0 dist 6.18486 6.78651 7.55216 14.2476 11.4528 9.17826 9.18218 4.48529 7.56888 10.6504 numMergedOcc 0
32 mol 248 unq 0 iso 0 dist 8.34646 6.21372 8.2965 14.594 11.762 8.71859 12.8567 10.8081 7.69895 4.53213 numMergedOcc 0
33 mol 248 unq 1 iso 0 dist 8.34646 6.21372 8.2965 14.594 11.762 8.71859 10.9878 5.86196 7.21521 6.33032 numMergedOcc 0
34 mol 258 unq 0 iso 0 dist 7.22378 6.8193 6.60405 14.6706 10.221 8.58088 10.6039 7.26417 6.42289 9.22664 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 6.49599 14.1932 8.13497 10.3275 5.71237 6.77279 16.2468 10.582 8.53687 7.55268 numMergedOcc 0
36 mol 259 unq 1 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 9.34738 4.86771 7.84554 9.10984 numMergedOcc 0
37 mol 259 unq 2 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 9.47382 6.96053 7.46176 11.8501 numMergedOcc 0
38 mol 259 unq 3 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 14.8529 10.4881 9.18903 13.9868 numMergedOcc 0
39 mol 259 unq 4 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 6.49599 4.86771 7.88519 5.71237 numMergedOcc 0
40 mol 259 unq 5 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 9.47382 7.64658 7.46176 11.8501 numMergedOcc 0
41 mol 259 unq 6 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 14.8529 5.87173 9.18903 13.9868 numMergedOcc 0
42 mol 259 unq 7 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 6.49599 6.96053 7.88519 5.71237 numMergedOcc 0
43 mol 259 unq 8 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 9.34738 7.64658 7.84554 9.10984 numMergedOcc 0
44 mol 259 unq 9 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 14.8529 10.5239 9.18903 13.9868 numMergedOcc 0
45 mol 276 unq 0 iso 0 dist 7.11272 5.75852 6.87396 13.5901 8.86096 9.05218 12.2355 6.88557 9.8993 5.72513 numMergedOcc 0
46 mol 282 unq 0 iso 0 dist 7.70229 8.93697 8.76532 9.40138 4.58403 5.67266 10.9708 10.0156 8.04483 9.63727 numMergedOcc 0
47 mol 282 unq 1 iso 0 dist 7.70229 8.93697 8.76532 9.40138 4.58403 5.67266 7.90792 4.66602 6.33524 5.04235 numMergedOcc 0
48 mol 282 unq 2 iso 0 dist 7.70229 8.93697 8.76532 13.9846 10.5698 5.80981 10.9708 10.0156 8.04483 9.60898 numMergedOcc 0
49 mol 282 unq 3 iso 0 dist 7.70229 8.93697 8.76532 13.9846 10.5698 5.80981 7.90792 4.66602 6.33524 8.37652 numMergedOcc 0
50 mol 282 unq 4 iso 0 dist 7.70229 8.93697 8.76532 10.9385 13.108 9.63346 10.9708 10.0156 8.04483 4.85461 numMergedOcc 0
51 mol 282 unq 5 iso 0 dist 7.70229 8.93697 8.76532 10.9385 13.108 9.63346 7.90792 4.66602 6.33524 8.85797 numMergedOcc 0
52 mol 282 unq 6 iso 0 dist 7.90792 8.93697 6.33524 9.40138 5.04235 5.67266 10.9708 5.39891 8.04483 9.63727 numMergedOcc 0
53 mol 282 unq 7 iso 0 dist 7.90792 8.93697 6.33524 9.40138 5.04235 5.67266 7.70229 4.66602 8.76532 4.58403 numMergedOcc 0
54 mol 282 unq 8 iso 0 dist 7.90792 8.93697 6.33524 13.9846 8.37652 5.80981 10.9708 5.39891 8.04483 9.60898 numMergedOcc 0
55 mol 282 unq 9 iso 0 dist 7.90792 8.93697 6.33524 13.9846 8.37652 5.80981 7.70229 4.66602 8.76532 10.5698 numMergedOcc 0
56 mol 282 unq 10 iso 0 dist 7.90792 8.93697 6.33524 10.9385 8.85797 9.63346 10.9708 5.39891 8.04483 4.85461 numMergedOcc 0
57 mol 282 unq 11 iso 0 dist 7.90792 8.93697 6.33524 10.9385 8.85797 9.63346 7.70229 4.66602 8.76532 13.108 numMergedOcc 0
