forcefield amber94 sys 0 0 1 view 40 0.30695 55 15 0.3496406 -0.007752559 0.9368518 0.6193295 0.7522264 -0.224914 -0.702981 0.6588591 0.2678103 -0.242 0.081124 -54.906 seed -1111 mol 1 atom 1 - C CT - 0 0.2805609 -1.347365 -0.4358553 3 2 s 3 s 6 s atom 2 - C CT - 0 1.640196 -0.4837846 -0.4358553 2 1 s 3 s atom 3 - C CT - 0 0.2805609 0.1546979 -0.4358553 4 2 s 1 s 4 s 5 s atom 4 - C CT - 0 -0.403426 1.222306 0.3695022 3 3 s 5 s 7 s atom 5 - C CT - 0 -0.403426 1.222306 -1.241213 2 4 s 3 s atom 6 - C CT - 0 -0.1476277 -2.12659 0.8215477 2 1 s 7 s atom 7 - C CT - 0 0.42434 2.261154 1.148731 4 4 s 6 s 8 s 9 s atom 8 - C ** - 0 0.07145146 1.613158 1.874304 1 7 s atom 9 - C ** - 0 0.8062158 2.777936 0.2821685 1 7 s endmol 1