0 mol 54 unq 0 iso 0 dist 8.10071 9.47176 6.09757 9.99699 8.13653 13.8377 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 8.10071 9.47176 6.09757 9.97805 5.44539 10.6728 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 8.01351 8.98201 16.0295 7.97927 5.78962 15.7562 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 8.01351 6.4026 11.4334 7.97927 5.78962 12.7008 numMergedOcc 0
4 mol 104 unq 0 iso 0 dist 9.0159 5.46461 12.6137 4.96991 5.90762 9.31703 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 7.99359 9.14514 13.8924 11.3887 9.86842 20.3815 numMergedOcc 0
6 mol 188 unq 0 iso 0 dist 8.48704 7.22511 8.75579 6.28664 9.98092 13.0136 numMergedOcc 0
7 mol 223 unq 0 iso 0 dist 4.30445 9.10041 7.75335 6.59509 6.03408 7.80764 numMergedOcc 0
8 mol 223 unq 1 iso 0 dist 9.10041 4.30445 7.75335 15.4738 9.29204 15.8605 numMergedOcc 0
9 mol 223 unq 2 iso 0 dist 9.10041 4.30445 7.75335 14.4135 9.14789 14.3989 numMergedOcc 0
10 mol 223 unq 3 iso 0 dist 9.10041 4.30445 7.75335 6.59509 7.80764 6.03408 numMergedOcc 0
11 mol 223 unq 4 iso 0 dist 9.10041 4.30445 7.75335 11.687 5.75896 10.8794 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 9.4961 8.08479 8.19601 10.3186 8.12204 14.1332 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 7.07099 8.83873 11.6004 14.7313 9.63694 17.7795 numMergedOcc 0
14 mol 266 unq 2 iso 0 dist 7.07099 8.83873 11.6004 7.14057 6.58277 14.1382 numMergedOcc 0
15 mol 266 unq 3 iso 0 dist 7.07099 8.3978 13.1611 14.7313 9.63694 21.9878 numMergedOcc 0
16 mol 266 unq 4 iso 0 dist 7.07099 8.3978 13.1611 7.14057 6.58277 8.12204 numMergedOcc 0
17 mol 266 unq 5 iso 0 dist 8.3978 7.07099 13.1611 7.14057 8.12204 6.58277 numMergedOcc 0
18 mol 266 unq 6 iso 0 dist 8.3978 8.83873 14.3542 7.14057 8.12204 14.1382 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 8.93979 7.69328 13.13 7.27711 8.57035 10.1912 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 7.61357 8.67836 7.98762 13.0755 8.57733 11.8457 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 7.61357 8.67836 7.98762 15.1044 9.05509 15.433 numMergedOcc 0
22 mol 280 unq 2 iso 0 dist 7.31523 7.60676 10.2247 11.1583 6.83927 14.6209 numMergedOcc 0
23 mol 280 unq 3 iso 0 dist 8.67836 7.61357 7.98762 11.8477 6.83927 11.8404 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.04355 8.50508 10.6227 14.8194 8.0935 17.5825 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.04355 8.50508 10.6227 14.8194 8.0935 17.5825 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.04355 8.50508 10.6227 14.8194 8.0935 17.5825 numMergedOcc 0
