0 mol 7 unq 0 iso 0 dist 8.88982 16.991 9.67164 20.7193 12.2041 5.99459 18.245 10.5461 6.88805 8.41585 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 5.33843 5.99459 14.6878 12.2041 9.67164 18.3465 12.2333 13.156 7.10621 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.00307 11.2808 9.48085 13.1745 10.9391 9.49421 13.255 11.9561 13.6145 5.04899 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.92438 3.73561 8.66539 7.66055 5.79773 5.38524 5.76106 11.715 5.61579 6.81627 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 9.92438 3.73561 8.66539 11.2215 10.8779 8.69057 5.76106 11.715 5.61579 7.32874 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 7.66055 3.73561 5.38524 11.2215 5.47421 8.69057 5.76106 6.81627 5.61579 7.32874 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 8.46609 12.2249 7.57295 13.7633 5.67502 8.4312 12.4802 6.43294 8.62476 8.7531 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 8.46609 12.2249 7.57295 12.0878 6.54743 7.48086 4.72836 6.65595 7.80499 8.90863 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 8.25679 5.7326 7.51139 12.8811 12.1547 7.80898 13.89 16.8013 12.1193 9.36773 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.29852 3.84897 7.7152 8.13273 6.59884 8.27883 6.56354 11.5113 4.99174 9.03572 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.29852 3.84897 7.7152 8.13273 6.59884 8.27883 6.68919 12.9844 8.67311 8.83255 numMergedOcc 0
11 mol 95 unq 2 iso 0 dist 8.29852 3.84897 7.7152 8.13273 6.59884 8.27883 14.1434 11.3446 15.6249 8.03644 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.22628 3.82475 6.39384 11.2519 7.69052 9.42082 17.2604 13.8473 15.3161 7.30858 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 5.22628 3.82475 6.39384 11.2519 7.69052 9.42082 10.0419 9.33865 6.63111 5.83991 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 5.22628 3.82475 6.39384 11.2519 7.69052 9.42082 6.8104 6.11741 6.07067 7.88312 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.29673 10.2739 8.26547 11.5292 5.61668 9.05342 9.35671 8.22656 4.88025 6.82262 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 6.44896 4.65378 5.64942 9.74252 5.76246 6.97962 4.94984 5.59424 6.35474 7.00794 numMergedOcc 0
17 mol 192 unq 1 iso 0 dist 6.44896 5.48435 7.43054 9.74252 5.76246 6.79229 4.94984 5.59424 5.25965 7.00794 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 7.14333 4.84686 5.64285 4.91961 10.2693 7.81215 11.5103 17.458 12.4252 9.45496 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 7.14333 4.84686 5.64285 4.91961 10.2693 7.81215 4.98993 10.701 5.75498 6.7625 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.29682 5.13757 9.07743 6.20344 4.69778 7.66153 5.56656 8.13497 8.8603 7.88519 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 5.29682 5.13757 9.07743 6.20344 4.69778 7.66153 6.08432 9.95973 5.8801 7.84554 numMergedOcc 0
22 mol 259 unq 2 iso 0 dist 5.29682 5.13757 9.07743 6.20344 4.69778 7.66153 10.3156 10.3935 11.8896 7.46176 numMergedOcc 0
23 mol 259 unq 3 iso 0 dist 5.29682 5.13757 9.07743 6.20344 4.69778 7.66153 9.55719 12.6839 5.81576 9.18903 numMergedOcc 0
24 mol 259 unq 4 iso 0 dist 6.20344 5.13757 7.66153 5.29682 4.69778 9.07743 5.48552 10.5767 6.73882 8.53687 numMergedOcc 0
25 mol 259 unq 5 iso 0 dist 6.20344 5.13757 7.66153 5.29682 4.69778 9.07743 5.56656 7.88519 8.8603 8.13497 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.70123 15.3157 9.57499 15.6541 11.8268 8.9682 24.2766 21.4606 17.6038 9.7748 numMergedOcc 0
27 mol 280 unq 0 iso 0 dist 9.0021 9.81388 6.02353 14.0039 5.51836 6.86234 12.6862 6.53701 4.90315 6.0664 numMergedOcc 0
