REMARK Name = BDB000570 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.289 0.453 -0.734 0.00 0.00 +0.164 C ATOM 2 O LIG 1 -0.115 1.169 -1.719 0.00 0.00 -0.292 OA ENDROOT BRANCH 1 3 ATOM 3 C LIG 1 -1.680 0.072 -0.338 0.00 0.00 +0.017 A ATOM 4 C LIG 1 -1.947 -0.741 0.771 0.00 0.00 +0.011 A ATOM 5 C LIG 1 -3.266 -1.068 1.100 0.00 0.00 +0.001 A ATOM 6 C LIG 1 -4.322 -0.589 0.326 0.00 0.00 +0.000 A ATOM 7 C LIG 1 -4.064 0.220 -0.779 0.00 0.00 +0.001 A ATOM 8 C LIG 1 -2.749 0.549 -1.110 0.00 0.00 +0.011 A ENDBRANCH 1 3 BRANCH 1 9 ATOM 9 C LIG 1 0.870 -0.061 0.097 0.00 0.00 +0.087 C BRANCH 9 10 ATOM 10 C LIG 1 2.209 0.424 -0.450 0.00 0.00 +0.082 C BRANCH 10 12 ATOM 11 C LIG 1 4.746 0.333 -0.074 0.00 0.00 +0.086 C ATOM 12 C LIG 1 3.371 -0.086 0.377 0.00 0.00 +0.131 C ATOM 13 O LIG 1 3.215 -0.803 1.365 0.00 0.00 -0.298 OA ENDBRANCH 10 12 ENDBRANCH 9 10 ENDBRANCH 1 9 TORSDOF 4