0 mol 7 unq 0 iso 0 dist 7.4516 5.30199 9.87885 9.18323 10.1841 9.68596 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.35318 5.51296 9.67164 5.78919 5.5683 8.72114 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.35318 9.9698 5.99459 8.04923 6.12483 5.99972 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 5.89912 6.76291 9.03564 9.90809 9.76482 7.16773 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.74947 6.46931 6.9362 12.2895 5.1678 9.97775 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 6.91989 9.87299 9.64383 16.0614 12.82 7.23884 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 6.91989 6.5508 7.54889 6.56349 3.92737 4.47349 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 6.91989 10.457 7.78931 6.56349 3.92737 5.65185 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.42942 10.5282 5.10496 6.56349 3.94967 6.7117 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 5.42942 6.5508 5.2571 6.56349 3.94967 4.47349 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 5.42942 10.457 8.7497 6.56349 3.94967 5.65185 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 4.54933 7.84178 8.80934 8.26447 7.1951 8.8822 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 4.54933 7.84178 8.80934 6.71684 3.84573 9.66219 numMergedOcc 0
13 mol 113 unq 2 iso 0 dist 8.97239 7.56889 8.80934 12.456 7.1951 8.8822 numMergedOcc 0
14 mol 113 unq 3 iso 0 dist 8.97239 7.56889 8.80934 11.6044 3.84573 9.66219 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.85021 9.96816 9.1998 15.0248 11.5269 9.94764 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 7.66537 4.7099 6.02086 7.80008 4.02702 7.44629 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.41415 4.97081 7.05695 8.58636 3.78314 7.76163 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 6.14089 10.75 8.19317 15.6896 10.0135 8.69356 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 8.99208 6.90369 9.74118 6.39535 3.92782 9.88863 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.32663 11.4616 7.20674 17.8481 13.8094 7.07965 numMergedOcc 0
