0 mol 2 unq 0 iso 0 dist 6.52386 5.88525 5.16393 14.1164 9.74371 11.1758 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 6.52386 8.73586 9.90307 14.1164 9.74371 17.0221 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 6.97361 8.57112 6.30345 6.46237 5.61016 11.2243 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 8.52125 8.57112 5.23 5.60763 7.11187 10.3178 numMergedOcc 0
4 mol 100 unq 2 iso 0 dist 8.52125 8.57112 5.23 13.5152 6.60356 10.859 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 6.79804 9.10985 13.2894 10.5919 9.32474 19.0795 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 6.79804 6.23711 9.59715 10.5919 9.32474 15.4705 numMergedOcc 0
7 mol 139 unq 0 iso 0 dist 8.27507 9.15824 10.9275 10.8123 9.75151 16.4686 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 6.32669 6.18881 3.79724 3.56357 8.56593 9.37915 numMergedOcc 0
9 mol 151 unq 0 iso 0 dist 5.89907 5.11555 4.53999 12.2991 8.40442 12.3347 numMergedOcc 0
10 mol 151 unq 1 iso 0 dist 5.89907 8.8107 7.42696 12.2991 8.40442 15.1802 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 8.77869 8.71322 7.40143 15.3374 8.954 15.4985 numMergedOcc 0
12 mol 249 unq 0 iso 0 dist 7.279 5.68936 9.43294 5.4063 4.46389 9.80025 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 8.9297 9.91856 7.44861 4.65989 6.51449 10.6859 numMergedOcc 0
14 mol 265 unq 0 iso 0 dist 8.22353 8.06252 5.87866 8.39994 9.56472 9.05568 numMergedOcc 0
15 mol 265 unq 1 iso 0 dist 8.22353 8.06252 5.87866 5.62902 9.50814 7.29987 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.33447 7.01175 9.68248 7.61055 5.28417 11.6172 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 3.90274 9.58747 8.62775 5.01049 5.28417 12.6278 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 3.90274 7.50074 9.68248 5.01049 5.28417 11.6172 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 8.80418 7.81415 12.1217 6.27944 7.88405 12.8944 numMergedOcc 0
