0 mol 24 unq 0 iso 0 dist 9.75144 6.00575 8.62284 7.49157 6.72423 9.41655 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.75144 6.00575 8.62284 7.73794 4.0664 6.803 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 7.33969 11.962 8.19733 16.8086 11.2159 8.55553 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 7.33969 11.962 8.19733 14.6186 8.56189 5.00813 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.47876 4.18004 8.87194 12.1279 8.85802 9.81554 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 7.22293 8.42713 8.87194 14.5106 8.85802 9.81554 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 8.39016 8.89062 7.54496 16.2909 9.67572 9.08732 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 6.99355 10.1287 7.54496 15.0154 9.67572 9.08732 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 7.39889 4.91594 9.05798 4.80684 3.71283 8.34342 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 7.39889 9.3046 5.85818 4.80684 3.71283 7.62197 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 9.63176 12.7179 9.05798 10.1864 3.71283 8.34342 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 9.63176 4.91132 5.85818 10.1864 3.71283 7.62197 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 6.19042 7.61939 9.87025 10.3523 12.2671 7.62197 numMergedOcc 0
13 mol 119 unq 5 iso 0 dist 7.44174 9.15779 9.05798 10.3523 3.71283 8.34342 numMergedOcc 0
14 mol 119 unq 6 iso 0 dist 7.44174 7.61939 5.85818 10.3523 3.71283 7.62197 numMergedOcc 0
15 mol 119 unq 7 iso 0 dist 8.43904 10.326 9.87025 16.741 12.2671 7.62197 numMergedOcc 0
16 mol 140 unq 0 iso 0 dist 8.19104 8.83949 8.01587 16.0661 12.9241 8.3735 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 8.33261 12.6979 7.01133 19.7713 13.3536 7.19893 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 8.33261 12.6979 7.01133 16.915 9.88741 6.37938 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.31887 13.9336 7.01126 13.2856 5.31608 6.90373 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 9.52936 8.41716 6.21206 9.84566 4.11581 9.12454 numMergedOcc 0
21 mol 184 unq 1 iso 0 dist 9.15417 5.72305 6.21206 11.546 4.11581 9.12454 numMergedOcc 0
22 mol 188 unq 0 iso 0 dist 6.90541 5.48276 7.48284 7.86092 4.61059 6.18257 numMergedOcc 0
23 mol 198 unq 0 iso 0 dist 7.90031 6.74772 8.15936 9.76973 8.56728 5.20846 numMergedOcc 0
24 mol 198 unq 1 iso 0 dist 7.21533 6.74772 8.16598 9.76973 6.76174 5.20846 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 9.19704 5.28092 5.42696 9.44789 3.72865 5.19567 numMergedOcc 0
26 mol 213 unq 0 iso 0 dist 4.26212 5.84474 7.37935 11.8574 10.4239 7.79105 numMergedOcc 0
27 mol 218 unq 0 iso 0 dist 7.18041 5.7776 6.86795 6.1896 4.24855 8.98941 numMergedOcc 0
28 mol 218 unq 1 iso 0 dist 7.18041 5.7776 6.86795 6.09255 5.31276 6.45381 numMergedOcc 0
29 mol 218 unq 2 iso 0 dist 7.18041 5.282 6.23898 6.1896 4.24855 5.4621 numMergedOcc 0
30 mol 218 unq 3 iso 0 dist 7.18041 5.282 6.23898 6.09255 5.31276 8.91819 numMergedOcc 0
31 mol 218 unq 4 iso 0 dist 7.17547 5.7776 6.61099 6.1896 10.7049 8.98941 numMergedOcc 0
32 mol 218 unq 5 iso 0 dist 7.17547 5.7776 6.61099 6.09255 4.36581 6.45381 numMergedOcc 0
33 mol 218 unq 6 iso 0 dist 7.13323 9.97783 6.61099 13.5775 10.7049 8.98941 numMergedOcc 0
34 mol 218 unq 7 iso 0 dist 7.13323 9.97783 6.61099 10.0144 4.36581 6.45381 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 7.66365 5.89666 5.2361 12.5053 14.0295 9.76731 numMergedOcc 0
36 mol 252 unq 1 iso 0 dist 7.66365 5.89666 5.2361 12.6598 10.3309 8.38599 numMergedOcc 0
