0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 6.26831 6.34883 4.04089 12.9149 12.5416 8.66548 10.8612 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 6.26831 9.19662 4.04089 12.9149 15.8082 8.66548 10.8612 numMergedOcc 0
2 mol 1 unq 0 iso 0 dist 9.00903 8.56884 9.01967 6.09918 7.94662 8.78328 4.50502 10.8992 5.96833 7.27254 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 9.78006 3.98483 7.98363 5.84314 5.8245 9.71516 7.05919 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 8.57077 6.33889 11.4878 9.78006 3.98483 10.4204 5.84314 5.8245 9.81658 7.05919 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.34347 6.73162 7.23546 8.44506 13.2876 8.13684 7.11305 14.8317 9.96121 6.38243 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.34347 9.16962 11.887 5.69955 10.6756 4.80984 8.25132 13.6027 5.84066 6.73167 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.69985 5.87358 9.46098 5.34214 9.14441 5.94311 6.35679 14.6042 8.38791 10.0098 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 7.77116 3.78311 8.96522 6.9194 12.31 6.55202 9.6121 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 7.77116 3.78311 8.96522 9.68677 7.64052 9.08536 9.57341 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 6.06638 7.75534 7.01257 9.46588 5.5703 5.83002 5.42561 8.96947 8.7789 9.48975 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 6.06638 7.75534 7.01257 9.46588 5.5703 5.83002 10.7549 11.4624 9.93613 8.66815 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 9.40098 8.19953 8.64911 8.37597 6.77927 8.5129 5.13732 11.2501 5.73591 8.54702 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 6.61986 8.19953 10.7113 8.37597 4.59567 8.5129 5.13732 8.08349 5.73591 8.54702 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 8.38865 11.0628 5.92529 4.1511 9.91384 7.79951 5.28771 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 8.65997 9.62609 14.6185 5.4694 11.0628 5.23507 14.6485 15.9467 9.8009 13.0314 numMergedOcc 0
16 mol 227 unq 2 iso 0 dist 8.65997 6.95902 6.43754 5.4694 11.0628 5.92529 4.69247 9.91384 7.79951 5.28771 numMergedOcc 0
17 mol 227 unq 3 iso 0 dist 7.09863 8.17891 9.13836 8.38865 12.9587 5.92529 4.1511 10.3016 7.79951 5.28771 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 8.34494 6.25105 10.3337 8.24186 11.7705 13.0974 5.53885 13.7549 7.36208 10.1303 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 6.56247 6.25105 11.216 8.24186 5.63086 13.0974 5.53885 11.1872 7.36208 10.1303 numMergedOcc 0
20 mol 234 unq 2 iso 0 dist 9.36357 6.25105 11.4315 8.24186 5.6819 13.0974 5.53885 10.5689 7.36208 10.1303 numMergedOcc 0
21 mol 234 unq 3 iso 0 dist 9.45496 9.5707 15.9563 7.5366 5.63086 16.5499 3.95629 11.1872 8.27411 10.1303 numMergedOcc 0
22 mol 234 unq 4 iso 0 dist 9.45496 9.5707 15.9563 7.5366 5.63086 16.5499 15.9732 20.7134 6.96257 22.3541 numMergedOcc 0
23 mol 234 unq 5 iso 0 dist 9.45496 7.85175 11.216 7.5366 5.63086 13.0974 3.95629 11.1872 7.36208 10.1303 numMergedOcc 0
24 mol 234 unq 6 iso 0 dist 6.7625 9.5707 14.4106 7.5366 5.6819 16.5499 3.95629 10.5689 8.27411 10.1303 numMergedOcc 0
25 mol 234 unq 7 iso 0 dist 6.7625 9.5707 14.4106 7.5366 5.6819 16.5499 15.9732 19.3876 6.96257 22.3541 numMergedOcc 0
26 mol 234 unq 8 iso 0 dist 6.7625 7.85175 11.4315 7.5366 5.6819 13.0974 3.95629 10.5689 7.36208 10.1303 numMergedOcc 0
27 mol 234 unq 9 iso 0 dist 8.41436 6.16063 11.3297 9.007 8.16888 7.54397 13.1872 17.3846 9.11572 10.0117 numMergedOcc 0
28 mol 234 unq 10 iso 0 dist 8.92474 6.16063 10.2563 9.007 5.3211 7.54397 13.1872 11.3419 9.11572 10.0117 numMergedOcc 0
29 mol 272 unq 0 iso 0 dist 8.48753 7.67853 6.64985 9.05222 6.59863 6.3139 5.12237 6.44147 8.84523 10.6235 numMergedOcc 0
30 mol 272 unq 1 iso 0 dist 8.48753 7.67853 6.64985 9.05222 6.59863 6.3139 5.41667 11.4951 6.95241 10.2298 numMergedOcc 0
