0 mol 5 unq 0 iso 0 dist 8.97274 6.86923 3.14155 5.70932 12.6411 9.95226 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.97274 6.86923 3.14155 7.67464 7.5815 4.60775 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 8.97274 6.86923 3.14155 9.39982 10.8072 8.64744 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 7.5815 4.60775 3.14155 7.67464 8.97274 6.86923 numMergedOcc 0
4 mol 5 unq 4 iso 0 dist 7.5815 4.60775 3.14155 8.28622 12.6411 9.95226 numMergedOcc 0
5 mol 5 unq 5 iso 0 dist 7.5815 4.60775 3.14155 7.02829 10.8072 8.64744 numMergedOcc 0
6 mol 10 unq 0 iso 0 dist 7.93277 9.6451 5.79151 8.34698 10.2416 7.55253 numMergedOcc 0
7 mol 10 unq 1 iso 0 dist 7.93277 5.8369 10.0013 8.34698 10.2416 8.06428 numMergedOcc 0
8 mol 10 unq 2 iso 0 dist 8.88888 9.6451 15.5615 8.34698 15.8695 7.55253 numMergedOcc 0
9 mol 10 unq 3 iso 0 dist 8.88888 5.8369 8.67329 8.34698 15.8695 8.06428 numMergedOcc 0
10 mol 28 unq 0 iso 0 dist 6.87842 8.94643 11.4558 12.5255 17.7636 9.28621 numMergedOcc 0
11 mol 28 unq 1 iso 0 dist 6.87842 8.94643 11.4558 11.2009 12.7609 8.36195 numMergedOcc 0
12 mol 30 unq 0 iso 0 dist 7.13565 9.71995 10.8938 9.60272 14.5304 6.93011 numMergedOcc 0
13 mol 32 unq 0 iso 0 dist 8.22628 5.42426 5.11803 5.07181 8.48429 8.03553 numMergedOcc 0
14 mol 32 unq 1 iso 0 dist 9.82819 5.42426 5.27648 5.07181 13.2691 8.03553 numMergedOcc 0
15 mol 41 unq 0 iso 0 dist 6.35506 7.16598 6.26697 4.67252 10.525 9.14632 numMergedOcc 0
16 mol 48 unq 0 iso 0 dist 8.8645 8.52681 4.88527 5.43494 10.4843 7.33788 numMergedOcc 0
17 mol 48 unq 1 iso 0 dist 8.8645 9.98769 5.56357 5.43494 10.4843 9.74351 numMergedOcc 0
18 mol 48 unq 2 iso 0 dist 8.3491 9.40291 5.43784 5.56042 10.0593 9.21776 numMergedOcc 0
19 mol 48 unq 3 iso 0 dist 8.3491 7.94814 4.57947 5.56042 10.0593 6.85843 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 7.92513 5.95109 5.54474 5.19836 11.6507 7.80646 numMergedOcc 0
21 mol 251 unq 0 iso 0 dist 9.65275 7.90148 3.45567 10.7701 10.5175 9.49019 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 8.9221 6.39822 3.14784 5.40028 9.51145 8.61077 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 8.9221 5.36518 5.95721 5.40028 9.51145 9.11585 numMergedOcc 0
24 mol 266 unq 2 iso 0 dist 9.51145 9.90506 3.68488 5.6921 10.1964 9.03341 numMergedOcc 0
25 mol 266 unq 3 iso 0 dist 9.51145 8.61077 3.14784 5.40028 8.9221 6.39822 numMergedOcc 0
26 mol 266 unq 4 iso 0 dist 9.51145 9.11585 5.95721 5.40028 8.9221 5.36518 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 6.42951 9.07744 10.5214 12.752 11.5117 8.42892 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 6.42951 9.07744 10.5214 15.2073 18.819 8.90967 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 5.83857 5.44942 5.96434 5.42655 11.0572 8.53689 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 5.83857 5.44942 5.96434 8.72516 5.32839 7.82157 numMergedOcc 0
31 mol 287 unq 2 iso 0 dist 5.32839 7.82157 5.96434 8.72516 5.83857 5.44942 numMergedOcc 0
32 mol 287 unq 3 iso 0 dist 5.32839 7.82157 5.96434 12.4945 11.0572 8.53689 numMergedOcc 0
33 mol 288 unq 0 iso 0 dist 5.83857 5.44942 5.96434 5.42655 11.0572 8.53689 numMergedOcc 0
34 mol 288 unq 1 iso 0 dist 5.83857 5.44942 5.96434 8.72516 5.32839 7.82157 numMergedOcc 0
35 mol 288 unq 2 iso 0 dist 5.32839 7.82157 5.96434 8.72516 5.83857 5.44942 numMergedOcc 0
36 mol 288 unq 3 iso 0 dist 5.32839 7.82157 5.96434 12.4945 11.0572 8.53689 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 5.83857 5.44942 5.96434 5.42655 11.0572 8.53689 numMergedOcc 0
38 mol 289 unq 1 iso 0 dist 5.83857 5.44942 5.96434 8.72516 5.32839 7.82157 numMergedOcc 0
39 mol 289 unq 2 iso 0 dist 5.32839 7.82157 5.96434 8.72516 5.83857 5.44942 numMergedOcc 0
40 mol 289 unq 3 iso 0 dist 5.32839 7.82157 5.96434 12.4945 11.0572 8.53689 numMergedOcc 0
