REMARK Name = BDB000577 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 O LIG 1 1.337 -2.361 -0.002 0.00 0.00 -0.297 OA ATOM 2 C LIG 1 0.794 -1.262 -0.125 0.00 0.00 +0.140 C ATOM 3 C LIG 1 1.579 0.015 0.008 0.00 0.00 +0.148 C ATOM 4 C LIG 1 0.767 1.173 0.525 0.00 0.00 +0.140 C ATOM 5 O LIG 1 1.288 2.075 1.181 0.00 0.00 -0.297 OA ATOM 6 C LIG 1 -0.675 1.267 0.083 0.00 0.00 +0.075 C ATOM 7 C LIG 1 -1.361 -0.080 0.244 0.00 0.00 +0.015 C ATOM 8 C LIG 1 -0.648 -1.154 -0.562 0.00 0.00 +0.075 C ENDROOT TORSDOF 0