0 mol 7 unq 0 iso 0 dist 8.8576 4.44694 5.51421 10.4545 8.41585 10.6104 14.2368 14.7759 14.9934 9.68596 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.80849 4.98987 6.11056 13.9888 8.86116 10.4744 20.1114 14.012 16.6031 9.41441 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.00307 8.65485 8.40051 7.95074 7.57578 13.466 10.0899 6.08585 8.78181 8.50222 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 6.00307 8.65485 8.40051 10.3928 7.17969 14.4191 10.0899 6.08585 8.78181 7.55264 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.13476 10.5752 5.97635 10.0565 6.83299 6.76462 6.54052 4.29856 4.38047 6.14538 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 8.64872 10.8989 6.95595 10.4239 7.79912 12.7957 15.5881 11.4997 18.3917 9.81166 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 4.31067 9.91645 5.9747 9.04817 5.08437 4.75138 8.33845 7.06961 10.9995 6.7117 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 4.31067 9.91645 5.9747 6.21302 6.10456 11.3628 8.33845 7.06961 10.9995 4.47349 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 4.31067 7.54723 4.50572 9.04817 5.08437 6.88489 8.33845 7.06961 11.1541 6.7117 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 4.31067 7.54723 4.50572 6.21302 6.10456 9.82583 8.33845 7.06961 11.1541 4.47349 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 8.94909 6.45157 5.86531 8.76089 7.11802 6.26797 13.7203 16.0138 14.2733 9.22232 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.94909 6.45157 5.86531 8.76089 7.11802 6.26797 12.3907 5.92062 6.42904 9.22661 numMergedOcc 0
12 mol 133 unq 2 iso 0 dist 8.94909 6.45157 5.86531 8.76089 7.11802 6.26797 14.2267 6.61891 10.0298 7.56378 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 7.86668 4.04112 8.62103 5.06314 6.18308 3.84723 11.3236 5.87279 10.7279 7.10826 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 8.18588 5.06075 8.40773 10.2076 7.4631 6.72492 10.0781 4.45049 10.5164 7.89524 numMergedOcc 0
15 mol 241 unq 1 iso 0 dist 8.18588 13.1806 9.18476 10.2076 7.4631 9.87799 10.0781 4.45049 12.949 7.89524 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 5.29682 6.00285 5.90645 5.56656 8.13497 10.4985 10.7258 8.41846 13.1095 7.98231 numMergedOcc 0
