0 mol 53 unq 0 iso 0 dist 8.70783 7.65728 6.73575 6.33588 9.06787 11.3091 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.33457 6.45963 10.6445 8.31422 8.82927 11.9838 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 8.87502 8.70819 10.6445 3.6395 8.82927 11.9838 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.61052 8.82919 9.17514 4.80894 5.14123 12.077 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 9.36203 6.31934 10.8346 8.91835 5.6359 12.0846 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 8.39198 7.64107 6.51973 4.28638 8.59846 8.28931 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 8.39198 7.53333 8.4153 4.28638 8.59846 10.0745 numMergedOcc 0
7 mol 116 unq 2 iso 0 dist 6.70803 7.64107 4.97273 4.28638 9.6001 8.28931 numMergedOcc 0
8 mol 116 unq 3 iso 0 dist 6.70803 7.53333 10.8341 4.28638 9.6001 10.0745 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.75212 8.04823 11.7952 6.98797 6.31404 9.09014 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 7.61768 7.67974 11.4018 11.0259 8.79027 17.8004 numMergedOcc 0
11 mol 211 unq 0 iso 0 dist 9.05403 7.49132 10.7664 4.80633 5.75044 10.3844 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 4.42722 8.17723 9.63307 9.41665 8.52022 14.8201 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 7.72115 9.06221 14.739 7.83075 5.29501 15.4752 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 6.43615 9.06221 14.6662 7.83075 8.81206 15.4752 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 9.24084 7.47103 5.29647 9.68392 7.95196 11.6401 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 7.03138 7.47103 6.56958 9.68392 6.759 11.6401 numMergedOcc 0
