REMARK Name = BDB055317 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CL LIG 1 -5.112 0.335 -0.573 0.00 0.00 -0.082 Cl ATOM 2 C LIG 1 -3.418 0.127 -0.289 0.00 0.00 +0.063 A ATOM 3 C LIG 1 -2.456 0.880 -0.975 0.00 0.00 +0.102 A ATOM 4 CL LIG 1 -2.852 2.070 -2.154 0.00 0.00 -0.078 Cl ATOM 5 C LIG 1 -1.117 0.621 -0.659 0.00 0.00 +0.156 A ATOM 6 O LIG 1 -0.038 1.241 -1.211 0.00 0.00 -0.452 OA ATOM 7 C LIG 1 1.081 0.716 -0.645 0.00 0.00 +0.156 A ATOM 8 C LIG 1 0.741 -0.262 0.291 0.00 0.00 +0.049 A ATOM 9 C LIG 1 1.809 -0.898 0.962 0.00 0.00 +0.071 A ATOM 10 CL LIG 1 1.372 -2.095 2.107 0.00 0.00 -0.081 Cl ATOM 11 C LIG 1 3.139 -0.545 0.682 0.00 0.00 +0.061 A ATOM 12 CL LIG 1 4.472 -1.300 1.482 0.00 0.00 -0.082 Cl ATOM 13 C LIG 1 3.425 0.440 -0.264 0.00 0.00 +0.045 A ATOM 14 C LIG 1 2.394 1.088 -0.945 0.00 0.00 +0.085 A ATOM 15 CL LIG 1 2.749 2.299 -2.107 0.00 0.00 -0.080 Cl ATOM 16 C LIG 1 -0.696 -0.320 0.279 0.00 0.00 +0.031 A ATOM 17 C LIG 1 -1.687 -1.062 0.953 0.00 0.00 +0.014 A ATOM 18 C LIG 1 -3.039 -0.828 0.660 0.00 0.00 +0.022 A ENDROOT TORSDOF 0