REMARK Name = BDB009291 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.913 -1.769 0.717 0.00 0.00 +0.094 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 1.752 -1.103 -0.359 0.00 0.00 +0.092 A ATOM 3 C LIG 1 2.901 -0.270 0.051 0.00 0.00 +0.099 A ATOM 4 C LIG 1 3.631 0.353 -0.940 0.00 0.00 +0.068 A ATOM 5 C LIG 1 4.718 1.144 -0.570 0.00 0.00 +0.017 A ATOM 6 C LIG 1 5.028 1.275 0.782 0.00 0.00 +0.020 A ATOM 7 C LIG 1 4.239 0.608 1.708 0.00 0.00 +0.111 A ATOM 8 C LIG 1 3.247 0.157 -2.339 0.00 0.00 +0.274 A ATOM 9 O LIG 1 3.871 0.698 -3.245 0.00 0.00 -0.266 OA ATOM 10 N LIG 1 2.166 -0.662 -2.563 0.00 0.00 -0.242 N ATOM 11 H LIG 1 1.875 -0.807 -3.526 0.00 0.00 +0.192 HD ATOM 12 N LIG 1 3.180 -0.165 1.378 0.00 0.00 -0.253 NA ATOM 13 N LIG 1 1.419 -1.282 -1.606 0.00 0.00 -0.173 NA ENDBRANCH 1 2 BRANCH 1 19 ATOM 14 C LIG 1 -2.491 -0.025 0.798 0.00 0.00 +0.072 A ATOM 15 C LIG 1 -2.347 0.747 1.957 0.00 0.00 +0.145 A ATOM 16 F LIG 1 -3.339 1.549 2.375 0.00 0.00 -0.204 F ATOM 17 C LIG 1 -1.178 0.710 2.714 0.00 0.00 +0.040 A ATOM 18 C LIG 1 -0.123 -0.109 2.319 0.00 0.00 +0.007 A ATOM 19 C LIG 1 -0.236 -0.895 1.165 0.00 0.00 -0.040 A ATOM 20 C LIG 1 -1.422 -0.842 0.409 0.00 0.00 +0.030 A BRANCH 14 23 ATOM 21 O LIG 1 -3.575 -1.441 -1.800 0.00 0.00 -0.275 OA ATOM 22 C LIG 1 -4.079 -0.620 -1.071 0.00 0.00 +0.221 C ATOM 23 N LIG 1 -3.666 0.021 0.049 0.00 0.00 -0.268 N ATOM 24 C LIG 1 -4.886 0.785 0.254 0.00 0.00 +0.123 C ATOM 25 C LIG 1 -5.430 0.115 -1.022 0.00 0.00 +0.115 C ENDBRANCH 14 23 ENDBRANCH 1 19 TORSDOF 3