REMARK Name = BDB060284 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.031 0.810 -2.167 0.00 0.00 +0.332 C ATOM 2 O LIG 1 1.365 1.178 -3.283 0.00 0.00 -0.246 OA ENDROOT BRANCH 1 4 ATOM 3 C LIG 1 -0.794 0.109 -0.621 0.00 0.00 +0.018 C ATOM 4 C LIG 1 -0.366 0.457 -1.845 0.00 0.00 +0.092 C BRANCH 3 7 ATOM 5 C LIG 1 -4.579 0.141 -0.543 0.00 0.00 +0.121 A ATOM 6 C LIG 1 -3.259 0.470 -0.851 0.00 0.00 +0.057 A ATOM 7 C LIG 1 -2.188 -0.267 -0.310 0.00 0.00 +0.020 A ATOM 8 C LIG 1 -2.454 -1.331 0.579 0.00 0.00 +0.127 A ATOM 9 C LIG 1 -3.779 -1.655 0.882 0.00 0.00 +0.050 A ATOM 10 C LIG 1 -4.830 -0.924 0.321 0.00 0.00 +0.049 A BRANCH 5 12 ATOM 11 C LIG 1 -5.502 1.863 -1.900 0.00 0.00 +0.277 C ATOM 12 O LIG 1 -5.698 0.773 -1.008 0.00 0.00 -0.495 OA ENDBRANCH 5 12 BRANCH 8 13 ATOM 13 O LIG 1 -1.361 -1.991 1.084 0.00 0.00 -0.495 OA ATOM 14 C LIG 1 -1.598 -3.054 1.998 0.00 0.00 +0.277 C ENDBRANCH 8 13 ENDBRANCH 3 7 ENDBRANCH 1 4 BRANCH 1 15 ATOM 15 O LIG 1 1.849 0.672 -1.098 0.00 0.00 -0.454 OA BRANCH 15 16 ATOM 16 C LIG 1 3.216 0.994 -1.373 0.00 0.00 +0.306 C BRANCH 16 17 ATOM 17 C LIG 1 4.080 0.757 -0.159 0.00 0.00 +0.146 A ATOM 18 O LIG 1 5.412 1.107 -0.361 0.00 0.00 -0.460 OA ATOM 19 C LIG 1 6.305 0.940 0.671 0.00 0.00 +0.244 A ATOM 20 C LIG 1 5.992 0.458 1.875 0.00 0.00 +0.199 A ATOM 21 C LIG 1 4.581 0.075 2.122 0.00 0.00 +0.226 A ATOM 22 O LIG 1 4.240 -0.373 3.211 0.00 0.00 -0.284 OA ATOM 23 C LIG 1 3.635 0.261 1.008 0.00 0.00 +0.100 A BRANCH 20 24 ATOM 24 O LIG 1 6.917 0.305 2.885 0.00 0.00 -0.501 OA ATOM 25 H LIG 1 6.409 -0.063 3.639 0.00 0.00 +0.292 HD ENDBRANCH 20 24 ENDBRANCH 16 17 ENDBRANCH 15 16 ENDBRANCH 1 15 TORSDOF 8