REMARK Name = BDB000659 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 O LIG 1 -3.627 0.279 0.282 0.00 0.00 -0.288 OA ATOM 2 C LIG 1 -2.420 0.175 0.185 0.00 0.00 +0.207 C ATOM 3 C LIG 1 -1.433 1.322 0.401 0.00 0.00 +0.229 C ATOM 4 O LIG 1 -1.706 2.464 0.689 0.00 0.00 -0.284 OA ATOM 5 C LIG 1 -0.099 0.759 0.187 0.00 0.00 +0.029 A ATOM 6 C LIG 1 -0.212 -0.600 -0.131 0.00 0.00 -0.029 A ATOM 7 C LIG 1 0.929 -1.347 -0.376 0.00 0.00 +0.005 A ATOM 8 C LIG 1 2.172 -0.708 -0.298 0.00 0.00 +0.000 A ATOM 9 C LIG 1 2.267 0.659 0.023 0.00 0.00 +0.001 A ATOM 10 C LIG 1 1.118 1.411 0.270 0.00 0.00 +0.012 A ATOM 11 C LIG 1 -1.637 -1.075 -0.160 0.00 0.00 +0.119 C ENDROOT TORSDOF 0