0 mol 20 unq 0 iso 0 dist 5.9809 8.19827 4.7579 6.31611 8.25405 11.8459 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.84066 7.84204 11.3766 4.80984 6.73167 12.526 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.13051 8.55712 9.88975 5.36808 6.87028 12.6666 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 5.51885 7.93956 8.25866 4.69847 7.59156 12.5815 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 7.46803 8.08798 5.94217 7.12863 8.68663 5.66207 numMergedOcc 0
5 mol 184 unq 0 iso 0 dist 7.59939 9.46392 11.8486 4.05428 7.32888 11.8298 numMergedOcc 0
6 mol 225 unq 0 iso 0 dist 8.91356 9.27079 14.9585 16.9887 9.57955 19.4457 numMergedOcc 0
7 mol 225 unq 1 iso 0 dist 8.91356 9.27079 14.9585 8.99405 9.87668 10.7681 numMergedOcc 0
8 mol 234 unq 0 iso 0 dist 6.96257 5.69634 4.70248 9.66782 8.52295 6.58003 numMergedOcc 0
9 mol 234 unq 1 iso 0 dist 6.86569 7.35086 4.70248 6.56378 8.52295 6.58003 numMergedOcc 0
10 mol 260 unq 0 iso 0 dist 8.5613 5.30187 10.6938 4.48119 9.65775 9.33382 numMergedOcc 0
11 mol 292 unq 0 iso 0 dist 5.84792 3.93401 3.08474 6.67435 9.2558 8.42359 numMergedOcc 0
12 mol 292 unq 1 iso 0 dist 8.73515 3.93401 6.12546 6.67435 9.84946 8.42359 numMergedOcc 0
