0 mol 29 unq 0 iso 0 dist 7.71924 5.36278 8.02814 4.10356 5.92844 7.28761 5.3571 7.71617 9.78134 6.0516 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.4438 4.34694 9.65371 11.6826 16.5585 8.80003 4.93697 7.75341 7.47162 12.0556 numMergedOcc 0
2 mol 114 unq 0 iso 0 dist 9.6874 6.54778 4.84565 13.6126 12.2822 9.68809 5.33859 12.707 8.40389 14.1047 numMergedOcc 0
3 mol 158 unq 0 iso 0 dist 7.07348 9.96635 10.9312 10.1247 15.0946 8.79758 7.76298 12.0644 7.68074 3.40919 numMergedOcc 0
4 mol 158 unq 1 iso 0 dist 7.07348 9.96635 10.9312 10.1247 15.0946 8.79758 8.17573 13.0344 9.1854 9.88034 numMergedOcc 0
5 mol 159 unq 0 iso 0 dist 7.60912 9.9368 13.4546 13.464 18.3295 7.67418 15.7186 19.6156 9.45909 3.29432 numMergedOcc 0
6 mol 183 unq 0 iso 0 dist 7.94469 8.84987 6.08215 7.51182 11.2888 8.05235 5.62792 8.51612 7.50455 4.03 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 11.4764 13.8683 8.11956 13.4486 13.507 8.09915 4.4877 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 11.533 8.78286 6.93215 10.8542 10.0723 7.80421 3.61565 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 6.41444 8.05949 7.48216 11.533 8.78286 6.93215 14.6074 16.6086 9.71107 12.0662 numMergedOcc 0
10 mol 210 unq 2 iso 0 dist 6.41444 8.05949 7.48216 11.533 8.78286 6.93215 13.6787 16.5751 9.7449 13.912 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 8.71944 8.82663 5.45067 9.33375 12.863 8.96074 4.22586 9.65116 7.92513 8.8184 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 7.6402 7.74348 13.5224 14.1635 20.4173 8.62356 7.69003 12.4099 8.75172 9.95991 numMergedOcc 0
