REMARK Name = BDB060410 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 3.672 -1.050 0.494 0.00 0.00 +0.030 C ATOM 2 C LIG 1 3.028 -2.274 0.958 0.00 0.00 +0.019 C ATOM 3 C LIG 1 1.707 -2.330 1.194 0.00 0.00 -0.013 C ATOM 4 C LIG 1 0.841 -1.117 0.974 0.00 0.00 +0.097 C ATOM 5 C LIG 1 1.410 -0.218 -0.134 0.00 0.00 +0.099 C ATOM 6 C LIG 1 0.639 1.097 -0.078 0.00 0.00 +0.172 C ATOM 7 C LIG 1 -0.842 0.967 -0.033 0.00 0.00 +0.029 A ATOM 8 C LIG 1 -1.443 -0.267 0.243 0.00 0.00 +0.030 A ATOM 9 C LIG 1 -2.840 -0.392 0.226 0.00 0.00 +0.035 A ATOM 10 C LIG 1 -3.641 0.719 -0.049 0.00 0.00 +0.034 A ATOM 11 C LIG 1 -3.030 1.954 -0.309 0.00 0.00 +0.024 A ATOM 12 C LIG 1 -1.639 2.081 -0.302 0.00 0.00 +0.014 A ATOM 13 O LIG 1 1.151 2.209 -0.131 0.00 0.00 -0.291 OA ATOM 14 C LIG 1 -0.601 -1.441 0.599 0.00 0.00 +0.172 C ATOM 15 O LIG 1 -1.084 -2.567 0.636 0.00 0.00 -0.291 OA ATOM 16 C LIG 1 2.911 -0.072 -0.030 0.00 0.00 +0.009 C ENDROOT BRANCH 1 18 ATOM 17 C LIG 1 5.926 -0.020 0.218 0.00 0.00 +0.231 C ATOM 18 N LIG 1 5.044 -1.017 0.610 0.00 0.00 -0.285 N ATOM 19 H LIG 1 5.463 -1.829 1.048 0.00 0.00 +0.155 HD ATOM 20 O LIG 1 5.631 1.038 -0.333 0.00 0.00 -0.274 OA BRANCH 17 21 ATOM 21 C LIG 1 7.387 -0.361 0.559 0.00 0.00 +0.177 C BRANCH 21 23 ATOM 22 C LIG 1 8.323 -0.391 -1.679 0.00 0.00 +0.101 C ATOM 23 N LIG 1 8.327 0.275 -0.382 0.00 0.00 -0.311 NA ATOM 24 H LIG 1 8.005 1.239 -0.519 0.00 0.00 +0.122 HD ENDBRANCH 21 23 ENDBRANCH 17 21 ENDBRANCH 1 18 BRANCH 10 25 ATOM 25 N LIG 1 -5.043 0.688 -0.078 0.00 0.00 -0.284 N ATOM 26 H LIG 1 -5.544 1.547 -0.301 0.00 0.00 +0.155 HD ATOM 27 C LIG 1 -5.890 -0.385 0.140 0.00 0.00 +0.231 C ATOM 28 O LIG 1 -5.562 -1.533 0.420 0.00 0.00 -0.274 OA BRANCH 27 29 ATOM 29 C LIG 1 -7.370 0.019 0.045 0.00 0.00 +0.177 C BRANCH 29 30 ATOM 30 N LIG 1 -7.525 1.232 -0.797 0.00 0.00 -0.311 NA ATOM 31 H LIG 1 -7.315 0.966 -1.763 0.00 0.00 +0.122 HD ATOM 32 C LIG 1 -8.908 1.698 -0.746 0.00 0.00 +0.101 C ENDBRANCH 29 30 ENDBRANCH 27 29 ENDBRANCH 10 25 TORSDOF 6