0 mol 1 unq 0 iso 0 dist 5.32412 8.99695 9.78282 10.242 13.6058 9.12196 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.98958 7.2612 14.1383 5.2549 9.15677 8.44506 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 5.87251 9.17687 7.56926 14.4151 14.9909 9.93832 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 5.87251 9.17687 7.56926 10.3283 9.16827 8.60739 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 9.28709 4.67358 7.98177 9.17087 7.95122 9.31969 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 9.28709 4.67358 7.98177 5.33532 9.74268 6.54023 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 8.74797 9.9387 8.91211 10.4339 13.4831 8.67766 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 8.74797 9.9387 8.91211 4.91393 11.2082 8.0831 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 9.08158 5.93793 9.26384 8.07661 14.5445 8.97264 numMergedOcc 0
9 mol 124 unq 1 iso 0 dist 9.08158 5.93793 9.26384 8.29712 16.4933 8.80896 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 9.17599 5.8367 11.473 11.9678 16.1333 7.36779 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 9.17599 5.8367 11.473 13.0109 14.0084 8.20836 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 8.78704 5.8367 9.96852 11.9678 16.9299 7.36779 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 8.78704 5.8367 9.96852 13.0109 15.2052 8.20836 numMergedOcc 0
14 mol 188 unq 0 iso 0 dist 6.43097 8.14959 9.69805 11.4039 16.0736 8.47347 numMergedOcc 0
15 mol 198 unq 0 iso 0 dist 9.77781 5.33789 11.1573 9.81415 16.8042 9.18635 numMergedOcc 0
16 mol 198 unq 1 iso 0 dist 9.77781 5.33789 11.1573 5.21925 5.80867 8.10985 numMergedOcc 0
17 mol 198 unq 2 iso 0 dist 8.80253 5.33789 4.75457 9.81415 12.9579 9.18635 numMergedOcc 0
18 mol 198 unq 3 iso 0 dist 8.80253 5.33789 4.75457 5.21925 9.4363 8.10985 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 9.6897 9.88251 15.0925 14.4147 21.2951 8.44861 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 9.6897 9.88251 15.0925 13.9684 20.4933 5.60393 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 7.89041 9.33359 6.35143 12.8358 12.4926 8.50331 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 8.2748 9.08064 10.7978 7.63032 12.8567 6.17052 numMergedOcc 0
23 mol 248 unq 1 iso 0 dist 8.2748 9.08064 10.7978 6.42334 10.9878 9.77666 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 8.7248 9.44744 5.01742 11.8815 10.9943 6.11473 numMergedOcc 0
25 mol 252 unq 1 iso 0 dist 8.7248 6.94319 9.65981 11.8815 10.9943 8.47784 numMergedOcc 0
26 mol 252 unq 2 iso 0 dist 8.7248 6.94319 9.65981 5.29359 13.703 8.66469 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 8.99817 9.00781 9.81565 9.92738 10.7182 9.05222 numMergedOcc 0
