0 mol 2 unq 0 iso 0 dist 9.52737 7.29506 13.355 9.45493 7.64304 14.57 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 6.02191 5.32613 4.09467 14.8353 9.27637 10.9235 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 6.69917 4.49593 6.37119 5.66714 7.28416 8.95154 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.61675 9.72637 6.60747 12.1831 7.09169 11.5885 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.58057 8.86914 3.91174 9.16445 6.77886 10.3805 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.99661 6.51132 13.129 5.41023 6.61823 8.85601 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 8.99661 8.38986 13.5737 5.41023 6.61823 10.6199 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 6.55773 7.87345 4.25001 10.3209 6.43433 6.87434 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 6.55773 7.87345 4.25001 13.9635 9.92283 11.5809 numMergedOcc 0
9 mol 112 unq 2 iso 0 dist 6.55773 9.01196 10.5877 10.3209 6.43433 16.5947 numMergedOcc 0
10 mol 112 unq 3 iso 0 dist 6.55773 9.01196 10.5877 13.9635 9.92283 20.451 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 9.14135 8.99827 3.94083 9.14127 9.02318 11.9962 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 9.14135 8.99827 3.94083 14.7238 9.74542 13.3633 numMergedOcc 0
13 mol 148 unq 2 iso 0 dist 9.14135 8.99827 3.94083 11.3515 7.97543 11.4505 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 9.12067 8.97634 3.99423 14.7649 9.6606 13.3193 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 9.12067 8.97634 3.99423 11.4349 7.85526 11.3898 numMergedOcc 0
16 mol 150 unq 2 iso 0 dist 9.12067 8.97634 3.99423 9.10666 8.94552 11.9796 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 7.77159 8.12953 4.83835 14.466 7.72144 10.5628 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 8.28222 8.87575 3.67696 6.7811 9.94125 9.86868 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 8.28297 8.50234 8.42449 7.37147 8.0144 12.6443 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 8.28297 8.50234 8.42449 13.1366 7.80841 15.848 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 8.45863 7.81831 8.28783 11.4345 7.05523 13.0289 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 8.45863 7.81831 8.28783 7.3913 8.46327 12.1684 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.52129 9.59909 6.43307 5.65307 5.52379 9.86678 numMergedOcc 0
24 mol 276 unq 0 iso 0 dist 8.96556 9.97709 5.72469 11.6308 6.70215 10.8848 numMergedOcc 0
25 mol 276 unq 1 iso 0 dist 8.96556 9.97709 5.72469 14.0743 7.25423 12.5954 numMergedOcc 0
26 mol 276 unq 2 iso 0 dist 8.96556 9.97709 5.72469 15.638 7.88706 12.2621 numMergedOcc 0
27 mol 276 unq 3 iso 0 dist 8.96556 9.97709 5.72469 4.73253 7.23916 10.906 numMergedOcc 0
28 mol 278 unq 0 iso 0 dist 6.06813 9.24462 5.78276 9.61803 7.67245 5.35705 numMergedOcc 0
29 mol 278 unq 1 iso 0 dist 6.06813 9.24462 5.78276 7.87608 9.12395 6.64378 numMergedOcc 0
