0 mol 26 unq 0 iso 0 dist 9.08976 4.20567 8.62693 13.1105 8.82012 10.2609 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.08976 4.20567 8.62693 4.76147 9.16962 4.09495 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 9.5209 12.9728 7.88576 12.4304 8.68559 14.4244 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 8.9881 12.4026 7.88576 4.5514 8.68559 14.4244 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 6.18729 6.08419 7.90328 4.73852 9.39469 10.071 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 6.18729 6.08419 7.90328 4.58978 4.76815 5.89399 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.32393 7.31124 5.44714 10.8558 6.81812 5.19652 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 8.45679 4.01262 8.0578 10.6596 7.20326 11.1675 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 8.45679 9.68432 8.78982 10.6596 7.20326 6.7814 numMergedOcc 0
9 mol 117 unq 2 iso 0 dist 9.77482 15.0483 9.58171 5.17524 6.62561 10.4485 numMergedOcc 0
10 mol 117 unq 3 iso 0 dist 9.77482 15.0483 9.58171 10.7342 7.63616 5.27151 numMergedOcc 0
11 mol 117 unq 4 iso 0 dist 9.0428 8.64874 8.0578 6.3368 7.20326 11.1675 numMergedOcc 0
12 mol 117 unq 5 iso 0 dist 9.0428 11.7573 8.78982 6.3368 7.20326 6.7814 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.70951 9.12471 8.95838 12.9683 7.39889 7.38295 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 9.70951 9.12471 8.95838 9.43252 9.63176 5.85391 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 9.70951 9.12471 8.95838 5.53626 7.44174 11.0075 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 9.70951 14.8806 9.47892 12.9683 7.39889 9.58951 numMergedOcc 0
17 mol 119 unq 4 iso 0 dist 9.70951 14.8806 9.47892 9.43252 9.63176 18.2257 numMergedOcc 0
18 mol 119 unq 5 iso 0 dist 9.70951 14.8806 9.47892 5.53626 7.44174 9.93013 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 6.21461 4.3164 9.70025 5.49497 7.37327 6.20895 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 7.40764 8.90679 7.83363 7.20791 9.43203 12.3957 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 7.8126 4.18587 9.74324 10.8225 5.65339 13.6747 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 8.26544 6.31621 8.52504 5.07226 8.71415 10.5784 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 6.59305 11.9227 9.94175 4.88998 5.38637 13.8985 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 6.59305 11.9227 9.94175 5.87189 6.55759 14.9782 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 6.59305 5.58605 8.81534 4.88998 5.38637 5.33567 numMergedOcc 0
26 mol 238 unq 4 iso 0 dist 6.59305 5.58605 8.81534 5.87189 6.55759 9.85437 numMergedOcc 0
27 mol 238 unq 5 iso 0 dist 9.13022 6.16765 9.46582 4.67735 7.67322 9.23693 numMergedOcc 0
28 mol 247 unq 0 iso 0 dist 9.06037 18.7999 9.76925 7.02325 6.6838 14.6138 numMergedOcc 0
29 mol 247 unq 1 iso 0 dist 9.06037 5.90757 9.6455 7.02325 6.6838 9.44194 numMergedOcc 0
30 mol 247 unq 2 iso 0 dist 8.09208 17.098 9.76925 5.82669 6.6838 14.6138 numMergedOcc 0
31 mol 247 unq 3 iso 0 dist 8.09208 3.80357 9.6455 5.82669 6.6838 9.44194 numMergedOcc 0
