0 mol 41 unq 0 iso 0 dist 6.68599 5.36895 8.61524 8.8712 8.45859 13.4686 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 5.29239 9.91591 4.93453 4.31131 7.82766 12.7322 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 9.29792 7.61377 15.8402 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.32033 8.27307 7.76775 12.3183 9.38568 14.2205 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 8.32033 6.92837 13.1847 12.3183 9.38568 18.8082 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.93275 9.29446 9.54341 9.62606 6.11101 10.1937 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 9.93275 5.8992 9.58336 9.62606 6.11101 12.4015 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.98532 8.3558 5.1767 12.2432 6.61645 9.68271 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 5.84349 7.90775 4.33346 6.56529 9.02905 7.51733 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 5.84349 8.49531 10.3965 6.56529 9.02905 15.0497 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 7.90927 8.84131 9.9427 13.541 9.51771 15.9196 numMergedOcc 0
11 mol 207 unq 0 iso 0 dist 5.65418 5.18312 6.32727 3.6796 8.29754 8.78499 numMergedOcc 0
12 mol 207 unq 1 iso 0 dist 5.65418 5.18312 6.32727 7.34337 8.85994 12.1243 numMergedOcc 0
13 mol 207 unq 2 iso 0 dist 4.70143 5.18312 7.53149 3.6796 5.77532 8.78499 numMergedOcc 0
14 mol 207 unq 3 iso 0 dist 4.70143 5.18312 7.53149 7.34337 8.75785 12.1243 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.33143 8.14464 14.7684 16.0567 7.78392 21.6671 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 8.33143 9.93754 6.89798 16.0567 7.78392 11.8942 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 5.41885 7.91348 5.96471 5.45887 9.09279 8.55044 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.20998 6.95233 5.98169 6.80038 7.36137 12.0003 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 6.20998 6.95233 5.98169 4.5731 4.95415 9.29666 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 6.20998 9.61741 13.6708 6.80038 7.36137 12.2565 numMergedOcc 0
21 mol 266 unq 3 iso 0 dist 6.20998 9.61741 13.6708 4.5731 4.95415 12.1684 numMergedOcc 0
22 mol 266 unq 4 iso 0 dist 6.20998 5.61056 10.2407 6.80038 7.36137 11.7178 numMergedOcc 0
23 mol 266 unq 5 iso 0 dist 6.20998 5.61056 10.2407 4.5731 4.95415 9.96191 numMergedOcc 0
24 mol 266 unq 6 iso 0 dist 8.78219 6.95233 13.8919 6.80038 6.83784 12.0003 numMergedOcc 0
25 mol 266 unq 7 iso 0 dist 8.78219 6.95233 13.8919 4.5731 6.38519 9.29666 numMergedOcc 0
26 mol 266 unq 8 iso 0 dist 8.78219 9.61741 16.7981 6.80038 6.83784 12.2565 numMergedOcc 0
27 mol 266 unq 9 iso 0 dist 8.78219 9.61741 16.7981 4.5731 6.38519 12.1684 numMergedOcc 0
28 mol 266 unq 10 iso 0 dist 8.78219 5.61056 14.0884 6.80038 6.83784 11.7178 numMergedOcc 0
29 mol 266 unq 11 iso 0 dist 8.78219 5.61056 14.0884 4.5731 6.38519 9.96191 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 7.29081 9.79022 11.0966 10.2633 8.13393 17.7665 numMergedOcc 0
31 mol 285 unq 0 iso 0 dist 8.17214 8.33653 5.93692 7.76515 6.07843 6.71946 numMergedOcc 0
32 mol 285 unq 1 iso 0 dist 8.17214 8.33653 5.93692 7.52611 9.66678 5.03601 numMergedOcc 0
33 mol 285 unq 2 iso 0 dist 4.49395 6.44657 9.237 5.32175 7.08681 5.03601 numMergedOcc 0
34 mol 285 unq 3 iso 0 dist 4.49395 6.44657 9.237 8.32005 4.95596 13.3277 numMergedOcc 0
35 mol 285 unq 4 iso 0 dist 4.49395 6.44657 9.237 7.07384 6.3508 13.1368 numMergedOcc 0
36 mol 285 unq 5 iso 0 dist 4.49395 6.44657 9.237 12.2276 8.3005 17.3828 numMergedOcc 0
37 mol 287 unq 0 iso 0 dist 4.98604 7.95849 5.10722 7.22067 8.73403 9.76232 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 4.98604 7.95849 5.10722 7.22067 8.73403 9.76232 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 4.98604 7.95849 5.10722 7.22067 8.73403 9.76232 numMergedOcc 0
