REMARK Name = BDB015262 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.330 -1.457 -0.699 0.00 0.00 +0.154 C ENDROOT BRANCH 1 2 ATOM 2 O LIG 1 -0.504 -2.619 -0.744 0.00 0.00 -0.388 OA ATOM 3 H LIG 1 0.084 -3.394 -0.742 0.00 0.00 +0.210 HD ENDBRANCH 1 2 BRANCH 1 4 ATOM 4 C LIG 1 -0.493 -0.164 -0.940 0.00 0.00 +0.118 C BRANCH 4 5 ATOM 5 N LIG 1 -1.358 0.264 0.184 0.00 0.00 -0.295 NA ATOM 6 C LIG 1 -2.607 -0.517 0.278 0.00 0.00 +0.120 C ATOM 7 C LIG 1 -3.674 -0.152 -0.736 0.00 0.00 -0.030 A ATOM 8 C LIG 1 -3.678 1.108 -1.361 0.00 0.00 -0.042 A ATOM 9 C LIG 1 -4.699 1.433 -2.264 0.00 0.00 +0.004 A ATOM 10 C LIG 1 -5.722 0.524 -2.529 0.00 0.00 +0.000 A ATOM 11 C LIG 1 -5.730 -0.719 -1.899 0.00 0.00 +0.000 A ATOM 12 C LIG 1 -2.551 2.078 -1.115 0.00 0.00 +0.051 C ATOM 13 C LIG 1 -4.713 -1.055 -1.005 0.00 0.00 +0.005 A ATOM 14 C LIG 1 -1.697 1.696 0.103 0.00 0.00 +0.089 C ENDBRANCH 4 5 ENDBRANCH 1 4 BRANCH 1 15 ATOM 15 C LIG 1 1.137 -1.417 0.606 0.00 0.00 +0.192 C BRANCH 15 16 ATOM 16 O LIG 1 2.136 -0.401 0.523 0.00 0.00 -0.373 OA BRANCH 16 17 ATOM 17 C LIG 1 2.785 -0.132 1.775 0.00 0.00 +0.132 C ATOM 18 C LIG 1 3.852 -1.201 2.133 0.00 0.00 +0.112 C ATOM 19 N LIG 1 5.218 -0.939 1.638 0.00 0.00 -0.314 NA ATOM 20 H LIG 1 5.724 -0.394 2.337 0.00 0.00 +0.122 HD ATOM 21 C LIG 1 5.179 -0.169 0.395 0.00 0.00 +0.081 C ATOM 22 C LIG 1 4.589 1.225 0.620 0.00 0.00 +0.018 C ATOM 23 C LIG 1 3.450 1.240 1.646 0.00 0.00 +0.034 C ENDBRANCH 16 17 ENDBRANCH 15 16 ENDBRANCH 1 15 TORSDOF 6