0 mol 4 unq 0 iso 0 dist 5.30385 6.97734 5.39676 11.0787 9.16617 10.9872 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.88546 5.68079 5.69755 5.63041 5.89412 8.4014 numMergedOcc 0
2 mol 15 unq 1 iso 0 dist 6.88546 5.68079 5.69755 13.452 7.07399 10.2811 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.3964 5.65754 9.63925 14.959 8.4051 13.6588 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.3964 5.65754 9.63925 7.79468 7.29868 12.2872 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.3964 5.65754 9.63925 9.85198 8.60554 9.30028 numMergedOcc 0
6 mol 41 unq 0 iso 0 dist 6.07294 8.45859 6.00929 8.85978 8.51663 8.53882 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.18097 7.51319 5.22259 10.5346 9.82915 13.3547 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 9.18097 8.49887 7.66499 10.5346 9.82915 15.6221 numMergedOcc 0
9 mol 85 unq 2 iso 0 dist 8.83135 9.43839 5.22259 18.2314 9.82915 13.3547 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 6.93893 8.91998 12.8723 14.4094 9.30539 17.2244 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 7.31426 6.34669 3.77771 5.60777 5.37007 4.17838 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 6.15654 6.61645 3.87825 5.1767 6.95572 9.68271 numMergedOcc 0
13 mol 92 unq 2 iso 0 dist 7.89887 6.61645 8.8033 5.1767 7.38677 9.68271 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 8.49831 8.09561 5.83776 10.0526 6.46461 10.1605 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 8.49831 9.07315 11.2086 10.0526 6.46461 15.3612 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 8.07946 9.27714 11.5349 5.23723 8.647 11.69 numMergedOcc 0
17 mol 174 unq 0 iso 0 dist 5.07761 8.46317 8.95182 12.6579 9.87122 18.8085 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 8.09776 7.56217 12.7379 10.977 6.72379 14.7152 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 8.09776 9.81055 15.4151 10.977 6.72379 15.9798 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 5.4455 7.56217 3.7326 13.445 8.65535 9.52922 numMergedOcc 0
21 mol 194 unq 3 iso 0 dist 5.4455 9.81055 7.29209 13.445 8.65535 11.7672 numMergedOcc 0
22 mol 194 unq 4 iso 0 dist 6.57575 7.96463 12.8597 11.4562 6.72379 16.7555 numMergedOcc 0
23 mol 198 unq 0 iso 0 dist 8.28295 7.94413 4.73496 4.81051 6.34616 6.77156 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.46973 9.41594 8.51539 18.5654 9.68728 15.6696 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 9.46973 9.92651 9.07662 18.5654 9.68728 17.2641 numMergedOcc 0
26 mol 204 unq 2 iso 0 dist 8.82861 6.46946 8.56684 9.54287 7.32294 13.0232 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 9.97458 9.3491 11.7712 10.5547 5.50492 15.6395 numMergedOcc 0
28 mol 292 unq 0 iso 0 dist 8.67838 9.29687 4.30125 11.3822 9.88863 9.82511 numMergedOcc 0
