0 mol 71 unq 0 iso 0 dist 5.75102 8.87417 5.15022 13.2306 8.39608 8.67545 numMergedOcc 0
1 mol 86 unq 0 iso 0 dist 9.94012 8.18563 11.0031 3.71103 13.4455 8.71941 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 9.8158 7.69406 9.69781 12.4809 12.8492 7.13726 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 4.46578 7.83401 5.94764 6.53566 5.9962 6.0733 numMergedOcc 0
4 mol 148 unq 0 iso 0 dist 8.80448 9.14135 12.1075 5.92269 12.3087 5.06687 numMergedOcc 0
5 mol 150 unq 0 iso 0 dist 8.78855 9.12067 12.1551 5.95123 12.3883 5.09809 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 8.66056 8.15524 13.2326 10.973 15.5605 6.92225 numMergedOcc 0
7 mol 158 unq 1 iso 0 dist 8.34722 8.15524 14.5885 10.973 19.0784 6.92225 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 9.89864 7.64106 13.1075 6.74862 9.21584 9.3832 numMergedOcc 0
9 mol 163 unq 1 iso 0 dist 9.89864 7.64106 13.1075 12.1164 18.9485 6.0247 numMergedOcc 0
10 mol 163 unq 2 iso 0 dist 9.89864 7.64106 13.1075 11.5172 17.4242 6.40873 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.74666 9.87623 12.7755 13.1389 19.0476 9.47421 numMergedOcc 0
12 mol 272 unq 0 iso 0 dist 9.10712 7.36125 14.227 11.2522 14.0187 8.62966 numMergedOcc 0
