0 mol 10 unq 0 iso 0 dist 7.57901 10.5858 5.40169 5.02729 5.59965 9.61828 5.76822 9.43029 11.4402 4.99208 numMergedOcc 0
1 mol 60 unq 0 iso 0 dist 8.6492 6.30425 4.65127 6.90833 8.97364 4.82351 6.39094 6.63448 5.71764 5.85676 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.27321 9.45647 8.91427 11.3732 6.74766 7.53895 3.62638 7.98985 8.69385 12.5617 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 5.20528 11.5334 8.70863 12.9555 9.66222 8.31077 4.78636 5.05893 12.7386 11.0952 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 5.20528 11.5334 8.70863 12.9555 9.66222 8.31077 7.24335 5.71866 14.1999 12.5181 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 9.86487 13.2927 9.77017 11.57 7.80873 7.22444 4.9759 8.72725 8.59786 8.72143 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.86487 13.2927 9.77017 11.57 7.80873 7.22444 6.59976 6.11407 9.00531 5.08111 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 9.63085 11.016 5.39061 7.37795 5.87084 5.67023 13.1596 7.75314 4.24991 6.11089 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 7.85849 17.112 9.30061 6.64576 6.40575 14.2253 15.9796 9.0176 4.935 15.0575 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 6.08299 9.75179 9.30061 5.87436 6.40575 14.2253 11.6261 9.0176 4.935 15.0575 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.10556 4.86119 4.46777 4.96213 6.83404 5.38571 6.83215 5.92302 5.25982 10.0208 numMergedOcc 0
11 mol 256 unq 0 iso 0 dist 5.58036 11.4701 8.89892 10.8477 6.33496 4.55079 5.52853 6.85663 7.20313 8.60707 numMergedOcc 0
12 mol 256 unq 1 iso 0 dist 5.58036 11.4701 8.89892 9.95403 6.00636 7.29918 5.52853 6.85663 7.20313 9.39697 numMergedOcc 0
13 mol 256 unq 2 iso 0 dist 5.58036 11.4701 8.89892 7.21464 7.81448 8.66399 5.52853 6.85663 7.20313 4.05082 numMergedOcc 0
14 mol 256 unq 3 iso 0 dist 5.58036 11.4701 8.89892 10.4702 8.54499 6.4708 5.52853 6.85663 7.20313 6.63324 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 4.76698 12.1177 7.99521 11.9795 9.32954 5.52447 4.87707 6.75725 11.362 9.07649 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 4.76698 12.1177 7.99521 11.9795 9.32954 5.52447 14.0463 9.31888 5.38958 9.46408 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 6.74022 12.9095 8.2997 8.85159 6.88827 5.36428 11.3961 8.60027 14.9951 13.3632 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 6.74022 12.9095 8.2997 9.16187 9.16942 14.986 11.3961 8.60027 14.9951 5.39432 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 6.71956 6.63088 7.85414 7.01915 8.20644 5.43373 10.3171 9.26157 14.6871 16.0346 numMergedOcc 0
