0 mol 7 unq 0 iso 0 dist 9.84857 7.62195 8.41173 13.472 10.1841 7.38748 11.7608 13.8674 7.15287 6.8464 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.84857 7.62195 8.41173 13.472 10.1841 7.38748 13.8251 15.8454 7.8893 9.15183 numMergedOcc 0
2 mol 129 unq 0 iso 0 dist 8.63018 5.0466 7.07421 6.65878 5.06265 7.6453 5.56946 6.29026 4.80675 8.00624 numMergedOcc 0
3 mol 129 unq 1 iso 0 dist 8.63018 5.0466 7.07421 6.65878 5.06265 7.6453 6.10584 11.4199 7.01358 8.42289 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 8.52428 7.75436 9.13646 5.47265 4.61905 5.32865 6.91778 12.9055 12.348 9.88662 numMergedOcc 0
5 mol 204 unq 0 iso 0 dist 7.19213 5.55359 7.00683 13.5496 8.61406 9.52029 21.4762 15.2431 18.5654 9.44947 numMergedOcc 0
6 mol 204 unq 1 iso 0 dist 5.67196 4.72843 7.00683 10.6489 8.61406 9.52029 18.2283 15.2431 18.5654 9.44947 numMergedOcc 0
7 mol 239 unq 0 iso 0 dist 8.68803 6.54316 9.59937 4.53228 5.94643 7.58554 8.37622 12.985 8.27566 7.78671 numMergedOcc 0
8 mol 244 unq 0 iso 0 dist 6.06284 5.45847 6.51428 12.6281 13.4155 7.79787 12.2021 16.5923 10.5547 9.21656 numMergedOcc 0
9 mol 258 unq 0 iso 0 dist 9.4886 12.1075 8.57305 11.4159 5.00751 6.33567 11.9201 5.81927 6.51074 7.69358 numMergedOcc 0
10 mol 258 unq 1 iso 0 dist 9.4886 12.1075 8.57305 11.4159 5.00751 6.33567 8.27707 6.09782 5.57797 7.57187 numMergedOcc 0
11 mol 265 unq 0 iso 0 dist 8.22353 5.62902 9.50814 8.01664 3.89234 7.52632 7.73011 9.72927 6.35501 6.45326 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 7.62562 10.4456 6.12202 16.7249 10.3702 9.34051 15.8929 9.02749 7.23876 8.88221 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 7.52227 9.59994 8.81903 9.78915 4.81768 8.04712 5.58906 6.60309 5.28949 6.03235 numMergedOcc 0
