REMARK Name = LIG000370 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.017 0.135 0.153 0.00 0.00 -0.035 A ATOM 2 C LIG 1 0.531 0.856 -0.933 0.00 0.00 +0.008 A ATOM 3 C LIG 1 1.909 1.037 -1.076 0.00 0.00 +0.049 A ATOM 4 C LIG 1 2.798 0.494 -0.147 0.00 0.00 +0.159 A ATOM 5 C LIG 1 2.298 -0.226 0.936 0.00 0.00 +0.049 A ATOM 6 C LIG 1 0.918 -0.406 1.082 0.00 0.00 +0.008 A ENDROOT BRANCH 1 13 ATOM 7 O LIG 1 -5.439 -0.115 -0.882 0.00 0.00 -0.275 OA ATOM 8 C LIG 1 -4.253 -0.125 -0.567 0.00 0.00 +0.219 C ATOM 9 N LIG 1 -3.607 1.028 -0.201 0.00 0.00 -0.256 N ATOM 10 H LIG 1 -4.162 1.873 -0.224 0.00 0.00 +0.157 HD ATOM 11 C LIG 1 -2.313 1.177 0.244 0.00 0.00 +0.227 C ATOM 12 O LIG 1 -1.915 2.284 0.601 0.00 0.00 -0.275 OA ATOM 13 C LIG 1 -1.476 -0.100 0.322 0.00 0.00 +0.106 C ATOM 14 C LIG 1 -1.969 -1.123 -0.706 0.00 0.00 +0.026 C ATOM 15 C LIG 1 -3.449 -1.398 -0.492 0.00 0.00 +0.097 C ENDBRANCH 1 13 BRANCH 4 16 ATOM 16 O LIG 1 4.122 0.745 -0.397 0.00 0.00 -0.322 OA BRANCH 16 17 ATOM 17 S LIG 1 5.322 0.051 0.457 0.00 0.00 +0.292 S ATOM 18 F LIG 1 6.665 0.561 -0.234 0.00 0.00 -0.027 F ATOM 19 O LIG 1 5.309 -1.381 0.232 0.00 0.00 -0.103 OA ATOM 20 O LIG 1 5.353 0.612 1.793 0.00 0.00 -0.103 OA ENDBRANCH 16 17 ENDBRANCH 4 16 TORSDOF 3