0 mol 17 unq 0 iso 0 dist 8.19749 9.48164 11.6317 9.84612 10.2527 18.6829 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.19749 9.48164 11.6317 9.31884 4.61249 8.30773 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 3.90209 6.91361 10.7166 9.66226 8.83348 14.6934 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 5.29346 9.69341 5.53632 9.04937 7.21894 4.99495 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 5.29346 9.69341 5.53632 9.51956 5.10198 5.88845 numMergedOcc 0
5 mol 119 unq 2 iso 0 dist 9.25484 9.69341 8.57466 9.04937 11.269 4.99495 numMergedOcc 0
6 mol 119 unq 3 iso 0 dist 9.25484 9.69341 8.57466 9.51956 5.19099 5.88845 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 5.74837 8.47144 7.00811 9.06613 8.33986 4.56165 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 4.46397 9.08829 6.56027 6.08141 9.21862 9.85607 numMergedOcc 0
9 mol 171 unq 1 iso 0 dist 4.46397 5.94881 5.07688 6.08141 9.21862 11.6944 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 8.82137 7.38163 5.00988 7.3879 10.735 9.52796 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 8.82137 7.38163 5.00988 9.70728 14.6187 15.1357 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.59687 8.26119 10.735 7.27978 12.4855 5.92931 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.79252 6.99065 4.98409 7.89739 10.1999 7.75271 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 8.79252 6.99065 4.98409 6.12161 8.68266 4.01146 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 8.79252 5.90507 6.99355 7.89739 10.1999 4.21442 numMergedOcc 0
16 mol 212 unq 3 iso 0 dist 8.79252 5.90507 6.99355 6.12161 8.68266 6.69225 numMergedOcc 0
17 mol 212 unq 4 iso 0 dist 8.09995 6.99065 6.8802 7.89739 11.9681 7.75271 numMergedOcc 0
18 mol 212 unq 5 iso 0 dist 8.09995 6.99065 6.8802 6.12161 5.90313 4.01146 numMergedOcc 0
19 mol 212 unq 6 iso 0 dist 8.09995 5.90507 11.5079 7.89739 11.9681 4.21442 numMergedOcc 0
20 mol 212 unq 7 iso 0 dist 8.09995 5.90507 11.5079 6.12161 5.90313 6.69225 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 7.67027 9.63438 15.1662 5.83278 5.67483 12.2675 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 4.88851 7.96696 5.71442 8.68931 4.76575 7.26857 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 7.65486 7.96696 8.88857 8.68931 7.79709 7.26857 numMergedOcc 0
