REMARK Name = BDB055786 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.434 -0.994 -2.546 0.00 0.00 +0.130 A ATOM 2 C LIG 1 2.366 -1.082 -1.492 0.00 0.00 +0.055 A ATOM 3 C LIG 1 2.074 -0.712 -0.133 0.00 0.00 +0.201 A ATOM 4 O LIG 1 2.955 -0.810 0.800 0.00 0.00 -0.287 OA ATOM 5 C LIG 1 0.734 -0.232 0.085 0.00 0.00 +0.114 A ATOM 6 C LIG 1 -0.196 -0.143 -0.984 0.00 0.00 -0.017 A ATOM 7 C LIG 1 0.153 -0.520 -2.282 0.00 0.00 +0.051 A ENDROOT BRANCH 5 8 ATOM 8 C LIG 1 0.228 0.211 1.455 0.00 0.00 +0.391 C ATOM 9 O LIG 1 -0.380 -0.659 2.171 0.00 0.00 -0.240 OA ATOM 10 O LIG 1 0.310 1.456 1.743 0.00 0.00 -0.240 OA ENDBRANCH 5 8 BRANCH 1 12 ATOM 11 C LIG 1 0.979 -1.399 -4.862 0.00 0.00 +0.252 C ATOM 12 O LIG 1 1.893 -1.387 -3.784 0.00 0.00 -0.472 OA ENDBRANCH 1 12 BRANCH 2 13 ATOM 13 C LIG 1 3.693 -1.570 -1.783 0.00 0.00 +0.058 C BRANCH 13 14 ATOM 14 C LIG 1 5.156 -2.016 -1.648 0.00 0.00 -0.030 C ATOM 15 C LIG 1 6.314 -2.288 -1.139 0.00 0.00 -0.048 C ATOM 16 C LIG 1 7.489 -2.830 -1.972 0.00 0.00 +0.026 C BRANCH 15 17 ATOM 17 C LIG 1 6.430 -2.049 0.248 0.00 0.00 +0.026 C BRANCH 17 18 ATOM 18 C LIG 1 6.095 -1.650 1.693 0.00 0.00 +0.030 C BRANCH 18 19 ATOM 19 C LIG 1 5.415 -1.169 2.987 0.00 0.00 -0.034 C ATOM 20 C LIG 1 4.764 -0.748 4.031 0.00 0.00 -0.048 C ATOM 21 C LIG 1 4.497 -1.834 5.133 0.00 0.00 +0.026 C ATOM 22 C LIG 1 5.284 0.601 4.643 0.00 0.00 +0.026 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 15 17 ENDBRANCH 13 14 ENDBRANCH 2 13 BRANCH 6 23 ATOM 23 C LIG 1 -1.533 0.337 -0.780 0.00 0.00 +0.031 C BRANCH 23 24 ATOM 24 C LIG 1 -2.952 0.860 -0.492 0.00 0.00 +0.030 C BRANCH 24 25 ATOM 25 C LIG 1 -4.239 1.353 -0.121 0.00 0.00 -0.038 A ATOM 26 C LIG 1 -4.494 1.658 1.217 0.00 0.00 +0.004 A ATOM 27 C LIG 1 -5.747 2.142 1.596 0.00 0.00 +0.000 A ATOM 28 C LIG 1 -6.745 2.320 0.637 0.00 0.00 +0.000 A ATOM 29 C LIG 1 -6.490 2.016 -0.702 0.00 0.00 +0.000 A ATOM 30 C LIG 1 -5.236 1.531 -1.081 0.00 0.00 +0.004 A ENDBRANCH 24 25 ENDBRANCH 23 24 ENDBRANCH 6 23 TORSDOF 10