0 mol 20 unq 0 iso 0 dist 7.77627 16.0555 9.0017 12.4397 6.22202 8.26091 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.81561 9.00405 9.38691 9.37411 8.92942 7.47395 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 9.88078 9.00405 8.65986 9.37411 11.253 7.47395 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 7.53599 9.00405 9.74724 9.37411 12.4229 7.47395 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 6.12382 12.1601 9.0017 8.36009 6.22202 8.26091 numMergedOcc 0
5 mol 33 unq 0 iso 0 dist 9.45316 10.9259 8.45145 12.9071 6.33349 4.78873 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 7.94809 10.2302 8.32093 11.6661 5.29172 7.7485 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 8.02428 4.9102 9.15754 10.16 5.54567 9.2057 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.82214 14.3352 7.67463 15.1781 7.59896 4.18248 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 9.76075 6.87591 7.24101 9.83758 12.2767 9.34782 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 6.21509 8.14689 9.43682 8.0889 3.47821 7.84207 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 6.21509 8.14689 9.43682 8.34958 6.10769 6.98791 numMergedOcc 0
12 mol 120 unq 2 iso 0 dist 6.21509 5.74365 8.0564 8.0889 3.47821 8.56947 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 9.96357 7.75948 9.8911 11.3663 4.86495 7.53342 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.87925 9.15827 9.64977 13.7516 13.3603 7.25595 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.87925 9.15827 9.64977 16.3985 11.4647 9.94825 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 5.15737 12.6856 8.53393 17.7868 13.7573 7.8598 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 5.15737 12.6856 8.53393 10.7962 10.0357 8.25286 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 5.15737 12.0551 7.24165 17.7868 13.7573 7.80711 numMergedOcc 0
19 mol 266 unq 3 iso 0 dist 5.15737 12.0551 7.24165 10.7962 10.0357 9.9965 numMergedOcc 0
