0 mol 7 unq 0 iso 0 dist 8.33249 9.26914 5.70161 11.7898 6.0323 7.15434 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 9.26914 4.57188 9.225 8.85869 12.3221 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.14422 9.26914 6.09254 9.225 7.5298 12.3221 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.14422 9.26914 6.09254 14.3388 8.94874 11.9671 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.42848 7.54869 13.9079 10.6473 6.10175 14.4402 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 7.42848 6.29729 10.4238 10.6473 6.10175 10.5929 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.5121 7.40411 11.1307 7.3032 7.19254 13.904 numMergedOcc 0
7 mol 60 unq 0 iso 0 dist 6.27903 7.00844 6.62193 5.06825 4.96897 9.92844 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 8.88571 6.97123 5.4671 8.75125 6.85094 10.5531 numMergedOcc 0
9 mol 61 unq 1 iso 0 dist 8.88571 9.532 10.1513 8.75125 6.85094 13.6393 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 7.76963 9.19402 5.31439 11.9775 7.71596 12.1702 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.60101 5.05103 5.81666 6.02783 6.52501 9.35428 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 8.83712 5.05103 5.56084 12.8347 8.16113 11.9574 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 8.64606 5.7191 5.90364 7.83675 4.95086 6.87299 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 8.64606 5.7191 5.90364 14.9083 8.39524 14.1227 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 7.72575 6.94119 12.1089 5.49386 7.2067 11.3009 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.09931 5.39213 10.591 10.921 8.40343 13.7557 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 8.78345 8.73695 5.03763 8.18585 5.69866 9.68918 numMergedOcc 0
18 mol 199 unq 0 iso 0 dist 6.33787 5.45511 4.26752 5.47687 7.29716 9.30897 numMergedOcc 0
19 mol 199 unq 1 iso 0 dist 6.33787 8.84275 7.44626 5.47687 7.29716 12.477 numMergedOcc 0
20 mol 202 unq 0 iso 0 dist 8.26224 9.38806 8.51162 5.74135 9.39364 10.8109 numMergedOcc 0
21 mol 231 unq 0 iso 0 dist 7.88488 6.52115 9.0084 6.57285 8.63896 12.206 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 6.89822 7.9828 6.68041 4.30824 8.37253 5.75874 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 6.89822 8.73296 10.1367 4.30824 8.37253 11.7532 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 7.43195 7.27446 5.11366 6.98305 5.10595 5.3051 numMergedOcc 0
