REMARK Name = BDB002564 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.154 0.062 0.237 0.00 0.00 -0.076 C ATOM 2 C LIG 1 1.317 0.115 -0.444 0.00 0.00 -0.028 C ATOM 3 C LIG 1 -0.227 -1.047 1.181 0.00 0.00 +0.039 C ENDROOT BRANCH 1 4 ATOM 4 C LIG 1 -0.839 1.208 0.136 0.00 0.00 +0.034 C BRANCH 4 5 ATOM 5 C LIG 1 -1.886 1.050 -0.976 0.00 0.00 +0.031 C BRANCH 5 8 ATOM 6 C LIG 1 -5.021 -1.095 0.004 0.00 0.00 +0.038 C ATOM 7 C LIG 1 -4.112 0.096 -0.150 0.00 0.00 -0.080 C ATOM 8 C LIG 1 -2.897 -0.034 -0.719 0.00 0.00 -0.028 C ATOM 9 C LIG 1 -4.676 1.382 0.388 0.00 0.00 +0.038 C ENDBRANCH 5 8 ENDBRANCH 4 5 ENDBRANCH 1 4 BRANCH 2 10 ATOM 10 C LIG 1 2.405 -0.920 -0.468 0.00 0.00 +0.029 C BRANCH 10 11 ATOM 11 C LIG 1 3.542 -0.672 0.534 0.00 0.00 +0.034 C BRANCH 11 12 ATOM 12 C LIG 1 4.432 0.562 0.313 0.00 0.00 +0.147 C ATOM 13 C LIG 1 4.929 0.721 -1.120 0.00 0.00 +0.036 C BRANCH 12 14 ATOM 14 N LIG 1 3.721 1.816 0.732 0.00 0.00 -0.066 NA ATOM 15 O LIG 1 4.296 2.393 1.662 0.00 0.00 -0.149 OA ENDBRANCH 12 14 ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 2 10 TORSDOF 7