0 mol 10 unq 0 iso 0 dist 7.36963 6.41686 6.50444 5.66953 7.74463 9.87224 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 6.62508 7.88348 9.3223 7.98722 7.2551 11.7565 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 9.77719 8.72422 9.3223 13.4678 7.2551 11.7565 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.31272 3.70978 5.41774 12.8112 7.78899 9.90363 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.06787 12.2544 5.40748 14.816 8.79235 8.86892 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 5.14123 5.90023 9.01601 5.87975 7.80026 5.09229 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 5.65006 5.94401 6.63973 7.2435 6.14248 7.7047 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 5.65006 5.94401 6.63973 8.53213 6.97936 4.00834 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 5.65006 5.94401 6.63973 5.28721 5.00466 9.6911 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.54537 14.7235 9.44737 17.974 9.76849 10.677 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 8.59846 9.33983 9.87191 6.51973 8.28931 8.77017 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 8.59846 5.16799 9.21528 6.51973 8.28931 7.43615 numMergedOcc 0
12 mol 116 unq 2 iso 0 dist 9.6001 13.5296 9.87191 4.97273 8.28931 8.77017 numMergedOcc 0
13 mol 116 unq 3 iso 0 dist 9.6001 11.9052 9.21528 4.97273 8.28931 7.43615 numMergedOcc 0
14 mol 144 unq 0 iso 0 dist 8.85737 4.28185 7.46026 9.10142 9.08956 10.8993 numMergedOcc 0
15 mol 146 unq 0 iso 0 dist 8.82192 3.96561 6.93154 14.2167 5.50187 11.6962 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 8.65328 9.52243 9.23064 10.9142 7.96541 5.27162 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 4.58113 5.21233 7.25438 5.61312 7.50697 10.6852 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.93282 10.1934 4.95855 5.98095 8.40328 6.92619 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 8.90555 10.1934 7.72489 5.98095 8.2518 6.92619 numMergedOcc 0
