REMARK Name = BDB015273 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.192 -1.651 -0.323 0.00 0.00 +0.154 C ENDROOT BRANCH 1 2 ATOM 2 O LIG 1 0.354 -0.548 -1.235 0.00 0.00 -0.388 OA ATOM 3 H LIG 1 -0.452 -0.004 -1.108 0.00 0.00 +0.210 HD ENDBRANCH 1 2 BRANCH 1 4 ATOM 4 C LIG 1 -1.301 -2.054 -0.347 0.00 0.00 +0.118 C BRANCH 4 5 ATOM 5 N LIG 1 -2.184 -0.874 -0.187 0.00 0.00 -0.295 NA ATOM 6 C LIG 1 -3.351 -0.983 -1.092 0.00 0.00 +0.120 C ATOM 7 C LIG 1 -4.371 0.119 -0.899 0.00 0.00 -0.030 A ATOM 8 C LIG 1 -4.432 0.844 0.304 0.00 0.00 -0.042 A ATOM 9 C LIG 1 -5.404 1.839 0.471 0.00 0.00 +0.004 A ATOM 10 C LIG 1 -6.329 2.095 -0.541 0.00 0.00 +0.000 A ATOM 11 C LIG 1 -6.285 1.366 -1.727 0.00 0.00 +0.000 A ATOM 12 C LIG 1 -3.412 0.592 1.384 0.00 0.00 +0.051 C ATOM 13 C LIG 1 -5.313 0.380 -1.905 0.00 0.00 +0.005 A ATOM 14 C LIG 1 -2.675 -0.742 1.198 0.00 0.00 +0.089 C ENDBRANCH 4 5 ENDBRANCH 1 4 BRANCH 1 15 ATOM 15 C LIG 1 0.697 -1.255 1.073 0.00 0.00 +0.192 C BRANCH 15 16 ATOM 16 O LIG 1 2.110 -1.433 1.242 0.00 0.00 -0.374 OA BRANCH 16 17 ATOM 17 C LIG 1 2.963 -0.571 0.469 0.00 0.00 +0.118 C ATOM 18 C LIG 1 4.385 -1.128 0.628 0.00 0.00 +0.031 C ATOM 19 C LIG 1 5.291 -0.811 -0.561 0.00 0.00 +0.002 C ATOM 20 C LIG 1 5.750 0.638 -0.671 0.00 0.00 +0.000 C ATOM 21 C LIG 1 4.628 1.673 -0.699 0.00 0.00 +0.000 C ATOM 22 C LIG 1 3.958 1.845 0.659 0.00 0.00 +0.002 C ATOM 23 C LIG 1 2.811 0.880 0.944 0.00 0.00 +0.031 C ENDBRANCH 16 17 ENDBRANCH 15 16 ENDBRANCH 1 15 TORSDOF 6