REMARK Name = BDB001666 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 O LIG 1 0.187 0.055 -0.470 0.00 0.00 -0.427 OA ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 -1.151 -0.376 -0.587 0.00 0.00 +0.113 C ATOM 3 C LIG 1 -1.984 -0.337 0.669 0.00 0.00 +0.081 C ATOM 4 C LIG 1 -3.498 -0.193 0.389 0.00 0.00 -0.021 C ATOM 5 C LIG 1 -4.280 -0.494 1.681 0.00 0.00 +0.012 C ATOM 6 C LIG 1 -3.836 1.248 -0.048 0.00 0.00 +0.012 C ATOM 7 C LIG 1 -3.918 -1.196 -0.702 0.00 0.00 +0.086 C ATOM 8 C LIG 1 -3.047 -1.115 -1.940 0.00 0.00 +0.160 C ATOM 9 O LIG 1 -3.467 -1.424 -3.053 0.00 0.00 -0.293 OA ATOM 10 C LIG 1 -1.634 -0.701 -1.792 0.00 0.00 +0.088 C ENDBRANCH 1 2 BRANCH 1 11 ATOM 11 C LIG 1 0.994 -0.767 0.266 0.00 0.00 +0.344 C ATOM 12 O LIG 1 0.678 -1.824 0.794 0.00 0.00 -0.245 OA BRANCH 11 17 ATOM 13 C LIG 1 6.392 1.321 0.693 0.00 0.00 +0.044 C ATOM 14 C LIG 1 4.999 0.781 0.551 0.00 0.00 -0.050 A ATOM 15 C LIG 1 4.024 1.509 -0.141 0.00 0.00 +0.004 A ATOM 16 C LIG 1 2.717 1.022 -0.250 0.00 0.00 +0.015 A ATOM 17 C LIG 1 2.368 -0.198 0.344 0.00 0.00 +0.059 A ATOM 18 C LIG 1 3.340 -0.919 1.050 0.00 0.00 +0.015 A ATOM 19 C LIG 1 4.645 -0.430 1.156 0.00 0.00 +0.004 A ENDBRANCH 11 17 ENDBRANCH 1 11 TORSDOF 3