0 mol 7 unq 0 iso 0 dist 8.80895 6.70503 5.51421 13.2787 6.769 6.8464 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.80895 7.6899 7.81271 13.2787 6.769 9.15183 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.25884 5.82571 8.04256 9.70484 4.85985 7.89424 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.52207 9.15202 6.58793 17.651 11.4201 9.67557 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 7.25891 4.31022 7.09405 6.5332 4.37836 7.32156 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 8.22824 11.4517 9.55556 16.8227 10.971 9.16358 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 7.7195 11.071 6.07091 11.2714 4.78402 7.73971 numMergedOcc 0
7 mol 171 unq 1 iso 0 dist 8.30819 10.3893 6.07091 13.0914 4.78402 7.73971 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 8.91036 9.63894 8.1088 10.1001 5.07225 9.80037 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 6.55106 7.68038 7.30954 15.2214 14.7871 8.02366 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 8.08891 4.68256 7.30954 11.0931 14.7871 8.02366 numMergedOcc 0
11 mol 187 unq 0 iso 0 dist 8.45366 10.7804 9.36086 15.1017 10.7172 6.82787 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 8.17234 11.0366 7.10634 10.5789 3.99138 9.40032 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 5.40329 12.338 9.89665 9.68784 4.93347 6.61371 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 9.01177 11.5884 6.1197 12.3546 7.86606 5.82903 numMergedOcc 0
