0 mol 67 unq 0 iso 0 dist 8.34804 10.7182 8.27009 3.77705 6.44825 11.2455 9.46247 11 17.692 8.3733 numMergedOcc 0
1 mol 67 unq 1 iso 0 dist 8.34804 5.66613 5.80736 3.77705 6.44825 3.83735 9.46247 11 12.0054 8.3733 numMergedOcc 0
2 mol 129 unq 0 iso 0 dist 7.13958 4.74644 7.6453 9.63308 9.31543 9.82512 9.28278 4.80675 8.00624 6.69691 numMergedOcc 0
3 mol 129 unq 1 iso 0 dist 7.13958 4.74644 7.6453 9.05571 8.85652 6.31483 9.28278 4.80675 8.00624 5.51197 numMergedOcc 0
4 mol 139 unq 0 iso 0 dist 5.77343 4.19005 8.78382 4.37138 7.20542 3.82037 6.34417 4.78289 8.96275 5.80789 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 5.31333 4.43567 9.2254 9.03587 5.27578 12.8633 10.799 7.82249 15.0175 9.3498 numMergedOcc 0
6 mol 186 unq 1 iso 0 dist 5.31333 4.43567 9.2254 9.03587 5.27578 12.8633 13.8056 9.09826 18.1056 7.05695 numMergedOcc 0
7 mol 225 unq 0 iso 0 dist 7.47852 5.9027 7.65121 11.1052 8.94981 11.8703 17.4302 17.0867 18.4783 8.1945 numMergedOcc 0
8 mol 225 unq 1 iso 0 dist 7.47852 5.9027 7.65121 11.1052 8.94981 11.8703 10.689 6.89798 13.147 6.50998 numMergedOcc 0
9 mol 225 unq 2 iso 0 dist 7.47852 5.9027 7.65121 3.60045 5.90986 4.88404 10.689 6.89798 13.147 9.09424 numMergedOcc 0
10 mol 225 unq 3 iso 0 dist 7.47852 5.9027 7.65121 10.6169 7.50697 13.6563 10.689 6.89798 13.147 8.14831 numMergedOcc 0
11 mol 225 unq 4 iso 0 dist 6.22332 4.95393 7.65121 13.5289 8.94981 11.8703 20.9931 17.0867 18.4783 8.1945 numMergedOcc 0
12 mol 225 unq 5 iso 0 dist 6.22332 4.95393 7.65121 13.5289 8.94981 11.8703 12.2756 6.89798 13.147 6.50998 numMergedOcc 0
13 mol 225 unq 6 iso 0 dist 6.22332 4.95393 7.65121 6.40342 5.90986 4.88404 12.2756 6.89798 13.147 9.09424 numMergedOcc 0
14 mol 225 unq 7 iso 0 dist 6.22332 4.95393 7.65121 9.92088 7.50697 13.6563 12.2756 6.89798 13.147 8.14831 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 8.06908 5.99165 8.54422 5.49348 8.40328 11.0103 9.54857 6.18571 13.119 5.85442 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 8.06908 5.99165 8.54422 5.49348 8.40328 11.0103 9.56653 12.3834 14.1987 6.9899 numMergedOcc 0
17 mol 259 unq 2 iso 0 dist 8.06908 5.99165 8.54422 5.13138 8.2518 10.099 14.0139 11.0067 17.5095 9.46361 numMergedOcc 0
18 mol 259 unq 3 iso 0 dist 8.06908 5.99165 8.54422 5.13138 8.2518 10.099 9.54857 6.18571 13.119 6.95511 numMergedOcc 0
19 mol 259 unq 4 iso 0 dist 8.06908 4.78344 7.67473 5.49348 8.40328 8.71577 9.54857 6.18571 10.895 5.85442 numMergedOcc 0
20 mol 259 unq 5 iso 0 dist 8.06908 4.78344 7.67473 5.49348 8.40328 8.71577 9.56653 12.3834 14.0551 6.9899 numMergedOcc 0
21 mol 259 unq 6 iso 0 dist 8.06908 4.78344 7.67473 5.13138 8.2518 6.47425 14.0139 11.0067 13.7569 9.46361 numMergedOcc 0
22 mol 259 unq 7 iso 0 dist 8.06908 4.78344 7.67473 5.13138 8.2518 6.47425 9.54857 6.18571 10.895 6.95511 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 9.80002 5.87385 5.78262 15.8245 6.95569 12.7125 17.9665 11.0966 16.2765 6.31969 numMergedOcc 0
24 mol 273 unq 1 iso 0 dist 9.80002 10.5975 7.6489 15.8245 6.95569 10.8576 17.9665 11.0966 15.7926 6.31969 numMergedOcc 0
25 mol 273 unq 2 iso 0 dist 6.73794 3.92089 5.78262 13.255 6.95569 12.7125 16.1263 11.0966 16.2765 6.31969 numMergedOcc 0
26 mol 273 unq 3 iso 0 dist 6.73794 12.0094 7.6489 13.255 6.95569 10.8576 16.1263 11.0966 15.7926 6.31969 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 12.2421 9.91103 13.1828 17.8158 16.3552 14.8509 9.57499 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 6.70414 12.5633 8.15119 12.2421 9.91103 13.1828 14.3464 10.4297 9.92831 5.46926 numMergedOcc 0
29 mol 277 unq 2 iso 0 dist 6.70414 12.5633 8.15119 12.2421 9.91103 13.1828 9.29635 5.77904 4.81916 8.9682 numMergedOcc 0
30 mol 277 unq 3 iso 0 dist 6.70414 12.5633 8.15119 10.9521 7.0603 10.6994 14.3464 10.4297 9.92831 5.13913 numMergedOcc 0
31 mol 277 unq 4 iso 0 dist 6.70414 12.5633 8.15119 10.9521 7.0603 10.6994 9.29635 5.77904 4.81916 6.92711 numMergedOcc 0
32 mol 280 unq 0 iso 0 dist 6.0218 4.65268 4.45141 5.55901 7.4869 4.06908 9.16248 6.07005 5.41639 6.02353 numMergedOcc 0
33 mol 280 unq 1 iso 0 dist 6.0218 4.65268 4.45141 5.55901 7.4869 4.06908 9.02427 7.38048 7.96485 6.86234 numMergedOcc 0
34 mol 285 unq 0 iso 0 dist 5.76796 11.2606 7.872 6.01574 6.24134 11.5704 12.0919 9.237 15.1926 7.80862 numMergedOcc 0
35 mol 285 unq 1 iso 0 dist 5.76796 8.7778 6.32984 6.01574 6.24134 4.4744 12.0919 9.237 8.46833 7.80862 numMergedOcc 0
