0 mol 26 unq 0 iso 0 dist 8.8533 8.69142 5.30297 4.18634 6.73167 6.07276 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.8533 8.69142 5.30297 13.421 7.40948 10.6018 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 6.87744 8.43523 5.30297 12.7209 6.73167 6.07276 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 6.87744 8.43523 5.30297 9.09086 7.40948 10.6018 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.8717 7.66913 12.5406 6.65242 9.58596 10.5579 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.94459 8.44761 13.7484 4.60844 8.05514 10.6667 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 5.94459 6.81124 11.9362 4.60844 8.05514 10.0742 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 5.9819 8.65004 5.91698 10.5025 5.43933 7.67238 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 5.9819 8.65004 5.91698 9.50897 4.99604 10.3786 numMergedOcc 0
9 mol 112 unq 2 iso 0 dist 5.9819 8.65004 5.91698 13.6247 9.97483 11.8232 numMergedOcc 0
10 mol 112 unq 3 iso 0 dist 5.9819 8.65004 5.91698 4.9759 7.44041 10.1906 numMergedOcc 0
11 mol 112 unq 4 iso 0 dist 5.9819 9.86487 15.0784 10.5025 5.43933 17.7626 numMergedOcc 0
12 mol 112 unq 5 iso 0 dist 5.9819 9.86487 15.0784 9.50897 4.99604 18.6669 numMergedOcc 0
13 mol 112 unq 6 iso 0 dist 5.9819 9.86487 15.0784 13.6247 9.97483 18.5304 numMergedOcc 0
14 mol 112 unq 7 iso 0 dist 5.9819 9.86487 15.0784 4.9759 7.44041 8.72725 numMergedOcc 0
15 mol 128 unq 0 iso 0 dist 7.90691 4.89256 5.19611 12.6206 9.12084 12.9649 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 6.03116 8.85675 10.4731 13.1744 9.82982 13.2829 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 7.87322 8.76228 11.4153 9.92222 7.17037 10.7396 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 8.22643 5.0778 6.74112 9.54898 6.34234 10.8593 numMergedOcc 0
19 mol 195 unq 1 iso 0 dist 8.22643 5.0778 6.74112 11.5968 7.87972 11.9372 numMergedOcc 0
20 mol 198 unq 0 iso 0 dist 5.33789 6.73371 9.86517 10.2325 8.8864 15.3535 numMergedOcc 0
21 mol 198 unq 1 iso 0 dist 5.33789 6.73371 9.86517 8.89394 8.12201 11.5067 numMergedOcc 0
22 mol 198 unq 2 iso 0 dist 5.33789 6.73371 9.86517 4.91277 5.45162 10.7287 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 9.33359 5.27184 5.92456 4.51728 9.14068 6.15635 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 9.33359 7.98527 10.9807 4.51728 9.14068 12.1535 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 8.79958 6.53769 9.97867 16.3287 9.07503 18.8783 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 8.79958 6.53769 9.97867 15.4224 7.63256 16.5656 numMergedOcc 0
