0 mol 25 unq 0 iso 0 dist 8.61491 13.395 6.85556 12.9168 9.62401 5.09159 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 7.96312 16.3577 9.52474 15.4799 7.60283 7.50515 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.67129 16.8196 9.52474 14.1714 7.60283 7.50515 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 6.07294 8.85978 8.51663 6.26099 6.42834 5.0364 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.23947 5.59762 9.97159 5.68492 9.32552 5.3948 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 6.07108 6.39047 9.49144 12.2982 9.0008 13.2018 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 6.07108 6.39047 9.49144 8.55107 9.77887 5.59327 numMergedOcc 0
7 mol 67 unq 2 iso 0 dist 5.63802 7.63289 9.49144 13.1761 9.0008 13.2018 numMergedOcc 0
8 mol 67 unq 3 iso 0 dist 5.63802 7.63289 9.49144 10.6102 9.77887 5.59327 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.66506 12.8388 9.24757 13.1044 7.10439 7.41074 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.18097 10.5346 9.82915 12.8729 6.05495 15.8792 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 8.83135 18.2314 9.82915 3.97167 6.05495 15.8792 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 7.31426 5.60777 5.37007 9.81259 7.1539 9.97281 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 6.15654 5.1767 6.95572 6.3678 6.72712 9.32974 numMergedOcc 0
14 mol 92 unq 2 iso 0 dist 6.15654 5.1767 6.95572 7.31722 5.39745 6.99832 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 6.86997 9.70656 9.91993 6.43817 8.73468 10.2478 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 6.86997 5.77745 9.99156 6.43817 8.73468 6.84291 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 7.46919 9.70656 6.22055 6.43817 9.73927 10.2478 numMergedOcc 0
18 mol 148 unq 3 iso 0 dist 7.46919 5.77745 8.18085 6.43817 9.73927 6.84291 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 6.79381 9.69704 9.96691 6.48058 8.73558 10.2318 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 6.79381 5.71213 9.8656 6.48058 8.73558 6.79619 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 7.36989 9.69704 6.14675 6.48058 9.66129 10.2318 numMergedOcc 0
22 mol 150 unq 3 iso 0 dist 7.36989 5.71213 7.94889 6.48058 9.66129 6.79619 numMergedOcc 0
23 mol 174 unq 0 iso 0 dist 5.07761 12.6579 9.87122 6.26251 7.47932 8.37744 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 8.79832 7.42609 9.77896 10.2578 5.4997 7.5414 numMergedOcc 0
25 mol 188 unq 0 iso 0 dist 6.20426 9.41911 8.10214 9.12244 9.33696 12.0548 numMergedOcc 0
26 mol 194 unq 0 iso 0 dist 8.09776 10.977 6.72379 8.91682 9.3402 5.38925 numMergedOcc 0
27 mol 194 unq 1 iso 0 dist 6.57575 11.4562 6.72379 11.7133 9.3402 5.38925 numMergedOcc 0
28 mol 194 unq 2 iso 0 dist 9.30761 5.55582 6.72379 4.90091 9.3402 5.38925 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 8.27761 10.1991 8.50102 4.87212 7.17337 8.78722 numMergedOcc 0
30 mol 232 unq 1 iso 0 dist 8.27761 13.7819 9.40808 4.87212 7.17337 13.5597 numMergedOcc 0
31 mol 279 unq 0 iso 0 dist 7.66302 11.8697 7.23721 13.6577 9.24367 5.34838 numMergedOcc 0
32 mol 292 unq 0 iso 0 dist 8.67838 11.3822 9.88863 9.01459 5.7131 5.98906 numMergedOcc 0
