0 mol 12 unq 0 iso 0 dist 4.85969 6.16894 4.62913 10.8052 7.18195 5.9021 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 4.85969 6.16894 4.62913 8.34132 6.70723 8.98466 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 6.45965 10.4274 7.9504 7.66002 8.59424 8.60149 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 8.19347 9.25469 7.96306 16.3522 12.6215 7.55357 numMergedOcc 0
4 mol 38 unq 1 iso 0 dist 8.19347 9.25469 7.96306 11.0065 5.47531 5.86972 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.35249 4.98983 6.49174 9.44826 4.3501 8.13653 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 6.35249 4.98983 6.49174 6.53191 5.31552 5.44539 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 9.79053 11.8289 9.00405 13.0435 6.73658 7.09393 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 9.79053 11.8289 9.00405 12.4477 6.55166 3.87167 numMergedOcc 0
9 mol 69 unq 2 iso 0 dist 8.76979 6.34034 9.00405 8.69782 6.73658 7.09393 numMergedOcc 0
10 mol 69 unq 3 iso 0 dist 8.76979 6.34034 9.00405 7.69888 6.55166 3.87167 numMergedOcc 0
11 mol 69 unq 4 iso 0 dist 9.08784 6.34034 5.06756 8.69782 6.60542 7.09393 numMergedOcc 0
12 mol 69 unq 5 iso 0 dist 9.08784 6.34034 5.06756 7.69888 3.36421 3.87167 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 6.15185 11.3589 9.8067 11.3135 8.14333 5.61016 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.04436 9.26106 8.66172 11.0353 10.2273 9.85967 numMergedOcc 0
15 mol 223 unq 0 iso 0 dist 7.30699 7.99016 7.29418 10.3328 5.59816 6.03408 numMergedOcc 0
16 mol 223 unq 1 iso 0 dist 9.5073 7.99016 8.63099 10.3328 4.04961 6.03408 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 6.67272 6.50848 7.54614 11.2469 9.97507 7.20862 numMergedOcc 0
18 mol 271 unq 0 iso 0 dist 9.27556 14.1222 9.80493 16.961 13.1235 8.07242 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 8.35178 10.4062 6.76192 11.6246 4.157 8.0935 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.35178 10.4062 6.76192 11.6246 4.157 8.0935 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 8.35178 10.4062 6.76192 11.6246 4.157 8.0935 numMergedOcc 0
