0 mol 115 unq 0 iso 0 dist 8.83712 12.8347 8.16113 6.85928 5.60716 5.97684 numMergedOcc 0
1 mol 147 unq 0 iso 0 dist 8.64606 7.83675 4.95086 6.49634 5.96285 5.16833 numMergedOcc 0
2 mol 147 unq 1 iso 0 dist 8.64606 14.9083 8.39524 6.49634 5.96285 8.80049 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 9.4113 7.15977 5.34451 7.32182 9.66935 9.8187 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 9.40822 6.9799 6.6175 7.28774 8.9891 9.6867 numMergedOcc 0
5 mol 175 unq 0 iso 0 dist 7.72575 5.49386 7.2067 6.083 6.84347 4.18777 numMergedOcc 0
6 mol 194 unq 0 iso 0 dist 8.78345 8.18585 5.69866 6.97669 5.40592 5.17358 numMergedOcc 0
7 mol 199 unq 0 iso 0 dist 6.33787 5.47687 7.29716 9.83598 8.97577 6.30608 numMergedOcc 0
8 mol 211 unq 0 iso 0 dist 7.79873 10.088 9.45365 10.827 9.97733 13.1369 numMergedOcc 0
9 mol 211 unq 1 iso 0 dist 7.79873 5.6174 7.15386 10.827 9.97733 9.91543 numMergedOcc 0
10 mol 211 unq 2 iso 0 dist 7.79873 4.00712 7.73993 10.827 9.97733 13.4388 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 7.28604 9.41453 9.05082 5.05642 6.44662 12.1713 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 7.50445 5.40449 8.8978 11.5838 8.79054 12.7871 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 7.43195 6.98305 5.10595 4.86651 9.01586 6.10503 numMergedOcc 0
