0 mol 26 unq 0 iso 0 dist 6.67455 9.90986 4.80254 14.3129 12.1996 9.12845 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.18251 7.57749 6.28248 14.3993 13.02 9.9787 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 5.02642 7.57749 3.66253 14.3993 13.0737 9.9787 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.41861 6.63973 6.1999 9.42791 11.0719 8.23026 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 8.9672 5.73799 3.82386 5.65355 9.48146 7.07095 numMergedOcc 0
5 mol 81 unq 1 iso 0 dist 9.80754 5.73799 11.4429 5.65355 14.6954 7.07095 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.73946 6.31773 5.34438 5.28901 9.26923 6.04595 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 5.16531 6.53559 9.54936 6.43966 11.3588 5.51197 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 5.16531 7.90844 9.63929 6.43966 11.3588 8.86944 numMergedOcc 0
9 mol 129 unq 2 iso 0 dist 6.65878 8.09774 6.31483 5.56946 8.00624 5.51197 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 5.74058 5.82945 6.5713 3.96103 9.0918 6.93139 numMergedOcc 0
11 mol 139 unq 0 iso 0 dist 9.71665 7.02063 3.82037 5.30274 8.96275 5.80789 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 8.65008 5.06116 7.59527 5.5065 6.36439 8.33439 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 9.22494 7.25009 12.7495 10.4606 15.4138 8.97626 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 7.32228 6.0033 6.57766 7.56497 8.67786 9.10817 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 7.32228 6.0033 6.57766 5.66137 10.1566 6.86828 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 9.85777 6.41148 6.16492 4.2475 6.94789 6.49765 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 8.47833 6.41148 10.1222 4.2475 11.2748 6.49765 numMergedOcc 0
18 mol 205 unq 2 iso 0 dist 5.05912 6.41148 9.99561 4.2475 6.23932 6.49765 numMergedOcc 0
19 mol 205 unq 3 iso 0 dist 5.47586 5.06713 10.1222 6.8901 11.2748 6.49765 numMergedOcc 0
20 mol 205 unq 4 iso 0 dist 6.60429 5.06713 9.99561 6.8901 6.23932 6.49765 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 8.01777 7.1229 8.98854 6.52848 7.41931 8.51625 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 6.91029 8.89714 9.23419 8.50795 12.7368 6.31969 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 7.38536 5.09181 4.4744 4.16039 8.46833 7.80862 numMergedOcc 0
