REMARK Name = BDB060655 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.154 -1.877 0.340 0.00 0.00 +0.132 C ATOM 2 N LIG 1 0.224 -1.027 -0.782 0.00 0.00 -0.296 N ATOM 3 C LIG 1 -0.588 -0.043 -1.339 0.00 0.00 +0.247 C ATOM 4 O LIG 1 -0.292 0.607 -2.338 0.00 0.00 -0.270 OA ENDROOT BRANCH 3 5 ATOM 5 C LIG 1 -1.884 0.266 -0.697 0.00 0.00 +0.037 A ATOM 6 C LIG 1 -1.927 0.760 0.612 0.00 0.00 +0.014 A ATOM 7 C LIG 1 -3.159 1.079 1.189 0.00 0.00 +0.019 A ATOM 8 C LIG 1 -4.342 0.919 0.455 0.00 0.00 +0.052 A ATOM 9 C LIG 1 -4.288 0.447 -0.863 0.00 0.00 +0.019 A ATOM 10 C LIG 1 -3.058 0.127 -1.443 0.00 0.00 +0.014 A BRANCH 8 11 ATOM 11 C LIG 1 -5.605 1.247 1.050 0.00 0.00 +0.099 C ATOM 12 N LIG 1 -6.627 1.507 1.535 0.00 0.00 -0.191 NA ENDBRANCH 8 11 ENDBRANCH 3 5 BRANCH 2 13 ATOM 13 C LIG 1 1.602 -1.128 -1.256 0.00 0.00 +0.142 C BRANCH 13 14 ATOM 14 C LIG 1 2.569 -0.430 -0.327 0.00 0.00 -0.030 A ATOM 15 C LIG 1 2.667 0.972 -0.335 0.00 0.00 +0.008 A ATOM 16 C LIG 1 3.542 1.625 0.533 0.00 0.00 +0.038 A ATOM 17 C LIG 1 4.318 0.878 1.411 0.00 0.00 +0.123 A ATOM 18 F LIG 1 5.157 1.504 2.247 0.00 0.00 -0.205 F ATOM 19 C LIG 1 4.236 -0.509 1.438 0.00 0.00 +0.038 A ATOM 20 C LIG 1 3.361 -1.165 0.570 0.00 0.00 +0.008 A ENDBRANCH 13 14 ENDBRANCH 2 13 TORSDOF 4