REMARK Name = BDB018263 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.227 -0.207 -0.928 0.00 0.00 +0.024 A ATOM 2 C LIG 1 0.653 0.587 -0.227 0.00 0.00 +0.117 A ATOM 3 N LIG 1 1.701 0.831 -1.071 0.00 0.00 -0.267 N ATOM 4 N LIG 1 1.558 0.249 -2.283 0.00 0.00 -0.179 NA ATOM 5 C LIG 1 0.384 -0.384 -2.188 0.00 0.00 +0.143 A ENDROOT BRANCH 1 7 ATOM 6 C LIG 1 -2.497 0.090 0.189 0.00 0.00 +0.135 A ATOM 7 C LIG 1 -1.468 -0.746 -0.450 0.00 0.00 +0.043 A ATOM 8 C LIG 1 -1.724 -2.064 -0.583 0.00 0.00 +0.101 A ATOM 9 N LIG 1 -2.894 -2.651 -0.135 0.00 0.00 -0.317 N ATOM 10 C LIG 1 -3.063 -4.085 -0.310 0.00 0.00 +0.152 C ATOM 11 C LIG 1 -3.889 -1.920 0.497 0.00 0.00 +0.255 A ATOM 12 O LIG 1 -4.939 -2.384 0.932 0.00 0.00 -0.268 OA ATOM 13 C LIG 1 -3.635 -0.466 0.638 0.00 0.00 +0.116 A BRANCH 6 14 ATOM 14 O LIG 1 -2.180 1.431 0.247 0.00 0.00 -0.491 OA BRANCH 14 16 ATOM 15 C LIG 1 -4.118 2.812 -0.232 0.00 0.00 +0.048 C ATOM 16 C LIG 1 -3.099 2.369 0.803 0.00 0.00 +0.226 C ENDBRANCH 14 16 ENDBRANCH 6 14 ENDBRANCH 1 7 BRANCH 3 17 ATOM 17 C LIG 1 2.864 1.664 -0.792 0.00 0.00 +0.178 C BRANCH 17 18 ATOM 18 C LIG 1 3.845 0.969 0.119 0.00 0.00 -0.026 A ATOM 19 C LIG 1 4.037 1.412 1.436 0.00 0.00 +0.005 A ATOM 20 C LIG 1 4.947 0.765 2.274 0.00 0.00 +0.000 A ATOM 21 C LIG 1 5.673 -0.328 1.807 0.00 0.00 +0.000 A ATOM 22 C LIG 1 5.490 -0.778 0.501 0.00 0.00 +0.000 A ATOM 23 C LIG 1 4.582 -0.134 -0.340 0.00 0.00 +0.005 A ENDBRANCH 17 18 ENDBRANCH 3 17 TORSDOF 5