0 mol 45 unq 0 iso 0 dist 9.69419 9.60864 7.0262 6.74214 7.18002 11.1846 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.02004 9.05101 6.21391 3.47529 9.54119 11.4443 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.02004 9.05101 6.21391 13.1138 7.87476 13.2186 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 6.35042 8.58319 6.62574 12.4809 9.54119 12.7368 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 6.35042 8.58319 6.62574 4.67004 7.87476 5.89173 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 7.77714 8.16033 9.78936 3.42062 9.77004 9.42099 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 7.77714 8.16033 9.78936 13.5492 8.36323 18.0538 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 6.46118 8.31952 6.98858 12.971 9.77004 13.1918 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 6.46118 8.31952 6.98858 4.70736 8.36323 5.72703 numMergedOcc 0
9 mol 55 unq 0 iso 0 dist 6.71884 9.3341 13.8239 9.96122 9.07741 15.6534 numMergedOcc 0
10 mol 55 unq 1 iso 0 dist 6.71884 9.3341 13.8239 5.32648 8.0388 10.8425 numMergedOcc 0
11 mol 55 unq 2 iso 0 dist 6.71884 9.3341 13.8239 12.7872 9.7883 17.2 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 6.89262 8.80308 10.5356 11.6207 9.78668 19.0299 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 6.77889 8.9967 6.14427 5.906 6.94015 11.3702 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 9.18505 9.68996 18.7407 4.88335 9.88156 12.2197 numMergedOcc 0
15 mol 136 unq 0 iso 0 dist 8.7469 4.91837 10.018 7.8989 8.11959 11.4052 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 6.86905 6.62283 11.9863 5.61713 9.91332 10.5377 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 6.86905 8.60978 13.0383 5.61713 9.91332 9.78013 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 7.82276 8.68638 12.1178 3.9472 7.33027 11.5459 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 7.87939 5.62193 5.4894 5.36106 9.92035 9.32971 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 6.87275 8.04121 4.60741 4.32613 7.45915 9.9444 numMergedOcc 0
21 mol 278 unq 1 iso 0 dist 7.02416 9.74549 7.44229 3.64811 7.45915 11.8664 numMergedOcc 0
22 mol 278 unq 2 iso 0 dist 7.02416 8.91606 14.4299 3.64811 7.45915 8.1769 numMergedOcc 0
