REMARK Name = BDB059160 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.774 -0.705 -0.489 0.00 0.00 +0.311 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 2.006 -0.231 0.272 0.00 0.00 +0.004 A ATOM 3 C LIG 1 2.259 -0.698 1.572 0.00 0.00 +0.009 A ATOM 4 C LIG 1 3.394 -0.277 2.269 0.00 0.00 +0.020 A ATOM 5 C LIG 1 4.286 0.611 1.671 0.00 0.00 +0.041 A ATOM 6 CL LIG 1 5.684 1.128 2.531 0.00 0.00 -0.084 Cl ATOM 7 C LIG 1 4.053 1.081 0.381 0.00 0.00 +0.020 A ATOM 8 C LIG 1 2.919 0.661 -0.317 0.00 0.00 +0.009 A ENDBRANCH 1 2 BRANCH 1 10 ATOM 9 O LIG 1 1.036 -1.601 -2.785 0.00 0.00 -0.246 OA ATOM 10 C LIG 1 1.152 -1.724 -1.575 0.00 0.00 +0.351 C BRANCH 10 11 ATOM 11 O LIG 1 1.641 -2.881 -1.069 0.00 0.00 -0.478 OA ATOM 12 H LIG 1 1.851 -3.415 -1.864 0.00 0.00 +0.295 HD ENDBRANCH 10 11 ENDBRANCH 1 10 BRANCH 1 13 ATOM 13 O LIG 1 0.142 0.454 -1.058 0.00 0.00 -0.473 OA BRANCH 13 14 ATOM 14 C LIG 1 -1.219 0.378 -0.973 0.00 0.00 +0.123 A ATOM 15 C LIG 1 -1.864 0.795 0.191 0.00 0.00 +0.058 A ATOM 16 C LIG 1 -3.263 0.744 0.274 0.00 0.00 +0.058 A ATOM 17 C LIG 1 -3.994 0.297 -0.840 0.00 0.00 +0.012 A ATOM 18 C LIG 1 -3.338 -0.094 -2.010 0.00 0.00 +0.004 A ATOM 19 C LIG 1 -1.947 -0.047 -2.079 0.00 0.00 +0.046 A BRANCH 16 20 ATOM 20 C LIG 1 -3.968 1.204 1.525 0.00 0.00 +0.418 C ATOM 21 F LIG 1 -3.276 0.907 2.661 0.00 0.00 -0.166 F ATOM 22 F LIG 1 -5.199 0.642 1.686 0.00 0.00 -0.166 F ATOM 23 F LIG 1 -4.164 2.550 1.547 0.00 0.00 -0.166 F ENDBRANCH 16 20 ENDBRANCH 13 14 ENDBRANCH 1 13 TORSDOF 6