REMARK Name = BDB055311 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CL LIG 1 4.127 2.523 -0.117 0.00 0.00 -0.084 Cl ATOM 2 C LIG 1 2.926 1.357 0.290 0.00 0.00 +0.042 A ATOM 3 C LIG 1 1.686 1.396 -0.364 0.00 0.00 +0.032 A ATOM 4 C LIG 1 0.705 0.438 -0.026 0.00 0.00 +0.031 A ATOM 5 C LIG 1 1.030 -0.500 0.948 0.00 0.00 +0.136 A ATOM 6 O LIG 1 -0.008 -1.345 1.159 0.00 0.00 -0.453 OA ATOM 7 C LIG 1 -1.021 -0.970 0.328 0.00 0.00 +0.157 A ATOM 8 C LIG 1 -2.269 -1.598 0.246 0.00 0.00 +0.103 A ATOM 9 C LIG 1 -3.197 -1.073 -0.671 0.00 0.00 +0.083 A ATOM 10 C LIG 1 -2.864 0.037 -1.466 0.00 0.00 +0.080 A ATOM 11 C LIG 1 -1.594 0.633 -1.345 0.00 0.00 +0.072 A ATOM 12 CL LIG 1 -1.091 1.990 -2.267 0.00 0.00 -0.081 Cl ATOM 13 CL LIG 1 -4.008 0.690 -2.602 0.00 0.00 -0.080 Cl ATOM 14 CL LIG 1 -4.766 -1.816 -0.814 0.00 0.00 -0.080 Cl ATOM 15 CL LIG 1 -2.600 -2.957 1.257 0.00 0.00 -0.078 Cl ATOM 16 C LIG 1 2.253 -0.562 1.613 0.00 0.00 +0.048 A ATOM 17 C LIG 1 -0.639 0.133 -0.434 0.00 0.00 +0.049 A ATOM 18 C LIG 1 3.207 0.397 1.261 0.00 0.00 +0.023 A ENDROOT TORSDOF 0