0 mol 32 unq 0 iso 0 dist 6.15129 6.35945 8.39998 4.72799 8.34024 7.48825 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 8.72396 8.64403 9.07904 7.15319 13.5965 8.47626 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.99189 5.667 7.43853 6.10692 14.6318 9.46312 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 9.79838 8.40088 6.45112 9.93702 14.8692 8.87941 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 6.00571 8.97156 7.34983 4.95538 8.03243 6.3244 numMergedOcc 0
5 mol 227 unq 0 iso 0 dist 9.94444 9.187 6.85729 5.38513 10.4091 6.152 numMergedOcc 0
6 mol 227 unq 1 iso 0 dist 9.94444 9.187 6.85729 13.6352 14.8055 7.95168 numMergedOcc 0
7 mol 234 unq 0 iso 0 dist 9.79506 5.99388 13.2121 5.04225 13.069 8.49841 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 7.19903 9.73021 5.28695 11.0761 10.4752 7.25543 numMergedOcc 0
9 mol 239 unq 1 iso 0 dist 7.71704 6.2537 6.62271 4.48867 11.0248 8.53287 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 6.79227 5.67172 5.84058 4.50424 10.5215 8.76313 numMergedOcc 0
11 mol 259 unq 1 iso 0 dist 6.79227 5.67172 5.84058 5.41805 11.278 7.4363 numMergedOcc 0
12 mol 284 unq 0 iso 0 dist 8.18785 5.49652 9.10558 5.89917 13.895 7.5746 numMergedOcc 0
