REMARK Name = BDB034092 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.490 0.550 0.208 0.00 0.00 +0.035 A ATOM 2 C LIG 1 -0.951 -0.694 0.536 0.00 0.00 +0.132 A ATOM 3 F LIG 1 -1.764 -1.748 0.702 0.00 0.00 -0.205 F ATOM 4 C LIG 1 0.422 -0.882 0.692 0.00 0.00 +0.062 A ATOM 5 C LIG 1 1.312 0.182 0.512 0.00 0.00 +0.035 A ATOM 6 C LIG 1 0.780 1.435 0.192 0.00 0.00 +0.062 A ATOM 7 C LIG 1 -0.597 1.607 0.041 0.00 0.00 +0.132 A ATOM 8 F LIG 1 -1.058 2.824 -0.282 0.00 0.00 -0.205 F ENDROOT BRANCH 1 15 ATOM 9 O LIG 1 -6.927 -0.479 -0.117 0.00 0.00 -0.275 OA ATOM 10 C LIG 1 -5.741 -0.163 -0.096 0.00 0.00 +0.219 C ATOM 11 N LIG 1 -5.042 -0.106 1.082 0.00 0.00 -0.256 N ATOM 12 H LIG 1 -5.562 -0.341 1.916 0.00 0.00 +0.157 HD ATOM 13 C LIG 1 -3.766 0.364 1.289 0.00 0.00 +0.227 C ATOM 14 O LIG 1 -3.343 0.512 2.434 0.00 0.00 -0.275 OA ATOM 15 C LIG 1 -2.978 0.759 0.041 0.00 0.00 +0.111 C ATOM 16 C LIG 1 -3.505 0.017 -1.192 0.00 0.00 +0.027 C ATOM 17 C LIG 1 -4.998 0.259 -1.339 0.00 0.00 +0.097 C ENDBRANCH 1 15 BRANCH 5 18 ATOM 18 N LIG 1 2.699 0.004 0.679 0.00 0.00 -0.329 N ATOM 19 C LIG 1 3.445 -1.216 0.529 0.00 0.00 +0.112 C ATOM 20 C LIG 1 4.708 -0.336 0.522 0.00 0.00 +0.049 C ATOM 21 C LIG 1 3.753 0.796 0.100 0.00 0.00 +0.112 C BRANCH 20 22 ATOM 22 C LIG 1 5.859 -0.691 -0.397 0.00 0.00 +0.162 C BRANCH 22 23 ATOM 23 O LIG 1 5.423 -0.846 -1.742 0.00 0.00 -0.395 OA ATOM 24 H LIG 1 5.048 -1.738 -1.835 0.00 0.00 +0.209 HD ENDBRANCH 22 23 ENDBRANCH 20 22 ENDBRANCH 5 18 TORSDOF 4