0 mol 81 unq 0 iso 0 dist 9.12919 10.3357 9.80754 11.932 5.73799 11.4429 numMergedOcc 0
1 mol 81 unq 1 iso 0 dist 9.12919 10.3357 9.80754 6.10195 8.38883 4.54161 numMergedOcc 0
2 mol 81 unq 2 iso 0 dist 9.12919 15.0067 8.9672 11.932 5.73799 3.82386 numMergedOcc 0
3 mol 81 unq 3 iso 0 dist 9.12919 15.0067 8.9672 6.10195 8.38883 11.9686 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 5.67586 12.0362 8.65008 4.78116 5.06116 7.59527 numMergedOcc 0
5 mol 192 unq 0 iso 0 dist 6.88947 7.41218 5.21088 8.2928 7.93715 6.62595 numMergedOcc 0
6 mol 192 unq 1 iso 0 dist 6.88947 5.09521 9.78743 8.2928 7.93715 13.2141 numMergedOcc 0
7 mol 192 unq 2 iso 0 dist 6.88947 14.6803 8.25609 8.2928 7.93715 12.1003 numMergedOcc 0
8 mol 193 unq 0 iso 0 dist 9.81938 5.16413 6.66555 11.924 7.85801 6.90307 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 8.22331 4.80458 7.32228 9.66766 6.0033 6.57766 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 9.31677 4.52889 9.03261 8.63354 9.71835 7.37944 numMergedOcc 0
11 mol 226 unq 1 iso 0 dist 9.31677 12.1893 7.67573 8.63354 9.71835 6.30585 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 7.55878 14.8036 8.01777 6.49444 8.7831 12.6648 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 7.55878 14.8036 8.01777 6.63339 9.61071 13.8023 numMergedOcc 0
14 mol 233 unq 2 iso 0 dist 7.55878 14.8036 8.01777 9.86764 7.1229 8.98854 numMergedOcc 0
15 mol 233 unq 3 iso 0 dist 4.91191 4.26152 8.01777 9.1334 8.7831 12.6648 numMergedOcc 0
16 mol 233 unq 4 iso 0 dist 4.91191 4.26152 8.01777 9.81222 9.61071 13.8023 numMergedOcc 0
17 mol 233 unq 5 iso 0 dist 4.91191 4.26152 8.01777 5.17683 7.1229 8.98854 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 6.54859 7.3073 6.94194 7.27242 8.58772 4.55363 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 7.90537 7.80956 9.54363 9.31424 7.27503 5.10825 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 9.33149 16.4251 7.38536 12.3683 8.69325 10.5146 numMergedOcc 0
21 mol 285 unq 1 iso 0 dist 9.33149 16.4251 7.38536 13.1909 5.09181 4.4744 numMergedOcc 0
22 mol 285 unq 2 iso 0 dist 5.77107 6.49869 7.38536 13.2325 8.69325 10.5146 numMergedOcc 0
23 mol 285 unq 3 iso 0 dist 5.77107 6.49869 7.38536 7.67857 5.09181 4.4744 numMergedOcc 0
