0 mol 16 unq 0 iso 0 dist 8.62634 6.68517 6.05535 9.97287 7.979 12.1997 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 6.68599 5.36895 8.61524 9.90336 7.10635 14.2172 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 8.33049 9.65672 8.1599 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.32033 8.27307 7.76775 11.5849 7.21809 11.4076 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 8.32033 8.27307 7.76775 5.10938 5.69055 5.47319 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 8.32033 6.92837 13.1847 11.5849 7.21809 17.4028 numMergedOcc 0
6 mol 69 unq 3 iso 0 dist 8.32033 6.92837 13.1847 5.10938 5.69055 9.8809 numMergedOcc 0
7 mol 69 unq 4 iso 0 dist 9.16791 8.29727 8.77472 15.1514 9.00405 17.6105 numMergedOcc 0
8 mol 69 unq 5 iso 0 dist 9.16791 8.29727 8.77472 9.90874 5.06756 12.9014 numMergedOcc 0
9 mol 70 unq 0 iso 0 dist 6.538 8.63742 6.39257 3.99657 8.60546 10.1951 numMergedOcc 0
10 mol 70 unq 1 iso 0 dist 9.26484 8.30653 11.3192 6.11801 8.60546 10.7471 numMergedOcc 0
11 mol 70 unq 2 iso 0 dist 9.26484 6.91739 6.39257 6.11801 8.60546 10.1951 numMergedOcc 0
12 mol 102 unq 0 iso 0 dist 7.90927 8.84131 9.9427 5.57291 9.22651 11.1118 numMergedOcc 0
13 mol 102 unq 1 iso 0 dist 7.90927 8.84131 9.9427 6.91222 5.32892 12.0912 numMergedOcc 0
14 mol 139 unq 0 iso 0 dist 7.83417 9.81432 7.05966 4.71927 5.77343 10.9937 numMergedOcc 0
15 mol 139 unq 1 iso 0 dist 7.83417 5.11962 4.78289 4.71927 5.77343 6.34417 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 9.55621 9.38169 4.98423 10.2744 5.82577 9.36086 numMergedOcc 0
17 mol 207 unq 0 iso 0 dist 4.70143 5.18312 7.53149 10.9621 8.27274 15.3007 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 7.21766 7.94344 3.99247 5.58634 7.1951 4.84709 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 8.33143 8.14464 14.7684 10.8895 7.47852 18.5869 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 8.33143 8.14464 14.7684 11.8099 6.22332 18.1296 numMergedOcc 0
21 mol 225 unq 2 iso 0 dist 8.33143 9.93754 6.89798 10.8895 7.47852 10.689 numMergedOcc 0
22 mol 225 unq 3 iso 0 dist 8.33143 9.93754 6.89798 11.8099 6.22332 12.2756 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 5.46484 8.95071 6.49831 5.05085 5.6568 6.11137 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 8.80671 7.49412 6.81625 10.8749 5.6568 7.89744 numMergedOcc 0
25 mol 271 unq 0 iso 0 dist 7.34621 7.9494 4.87282 4.7953 7.29764 10.183 numMergedOcc 0
26 mol 273 unq 0 iso 0 dist 7.29081 9.79022 11.0966 15.0113 9.80002 17.9665 numMergedOcc 0
27 mol 273 unq 1 iso 0 dist 7.29081 9.79022 11.0966 13.9951 6.73794 16.1263 numMergedOcc 0
28 mol 280 unq 0 iso 0 dist 4.55639 6.94723 6.96139 6.49238 7.78355 10.6395 numMergedOcc 0
29 mol 280 unq 1 iso 0 dist 7.72152 6.52188 6.96139 12.6225 7.78355 10.6395 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 4.49395 6.44657 9.237 9.78456 5.76796 12.0919 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 4.98604 7.95849 5.10722 4.91435 7.47179 7.26542 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 4.98604 7.95849 5.10722 4.91435 7.47179 7.26542 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 4.98604 7.95849 5.10722 4.91435 7.47179 7.26542 numMergedOcc 0
