0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 12.9149 12.5416 8.66548 12.412 7.29879 5.96303 6.94943 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 12.9149 15.8082 8.66548 12.412 11.9599 5.96303 6.94943 numMergedOcc 0
2 mol 1 unq 0 iso 0 dist 9.00903 8.56884 9.01967 4.50502 10.8992 5.96833 6.09918 7.94662 8.78328 7.27254 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 5.84314 5.8245 9.71516 9.78006 3.98483 7.98363 7.05919 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 8.57077 6.33889 11.4878 5.84314 5.8245 9.81658 9.78006 3.98483 10.4204 7.05919 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.34347 6.73162 7.23546 7.11305 14.8317 9.96121 8.44506 13.2876 8.13684 6.38243 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.34347 9.16962 11.887 8.25132 13.6027 5.84066 5.69955 10.6756 4.80984 6.73167 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 7.58835 9.20119 6.89191 12.466 12.457 5.81001 13.2858 9.14493 4.52443 7.72462 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 6.9194 12.31 6.55202 7.77116 3.78311 8.96522 9.6121 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 9.68677 7.64052 9.08536 7.77116 3.78311 8.96522 9.57341 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 9.87172 6.19042 6.35763 6.20019 6.99446 6.13374 13.1741 4.99056 11.1324 9.57341 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 9.87172 7.44174 7.36192 12.4621 11.2897 6.55202 13.1741 4.99056 8.96522 9.6121 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 9.87172 7.44174 7.36192 6.20019 6.99446 9.08536 13.1741 4.99056 8.96522 9.57341 numMergedOcc 0
13 mol 119 unq 5 iso 0 dist 6.18601 8.43904 10.3457 4.39676 8.95212 6.13374 12.6868 13.52 11.1324 9.57341 numMergedOcc 0
14 mol 126 unq 0 iso 0 dist 6.06638 7.75534 7.01257 10.7549 11.4624 9.93613 9.46588 5.5703 5.83002 8.66815 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 9.40098 8.19953 8.64911 5.13732 11.2501 5.73591 8.37597 6.77927 8.5129 8.54702 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 6.61986 8.19953 10.7113 5.13732 8.08349 5.73591 8.37597 4.59567 8.5129 8.54702 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 4.1511 9.91384 7.79951 8.38865 11.0628 5.92529 5.28771 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 4.69247 9.91384 7.79951 5.4694 11.0628 5.92529 5.28771 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 7.09863 8.17891 9.13836 4.1511 10.3016 7.79951 8.38865 12.9587 5.92529 5.28771 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 9.45496 9.5707 15.9563 15.9732 20.7134 6.96257 13.7892 15.1535 9.66782 8.52295 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 6.7625 9.5707 14.4106 15.9732 19.3876 6.96257 13.7892 14.3432 9.66782 8.52295 numMergedOcc 0
22 mol 234 unq 2 iso 0 dist 8.41436 6.16063 11.3297 13.1872 17.3846 9.11572 12.4869 12.4853 8.16702 9.08151 numMergedOcc 0
23 mol 234 unq 3 iso 0 dist 8.92474 6.16063 10.2563 13.1872 11.3419 9.11572 12.4869 10.3616 8.16702 9.08151 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 8.48753 7.67853 6.64985 5.41667 11.4951 6.95241 11.8555 10.5804 4.61146 9.30437 numMergedOcc 0
