REMARK Name = BDB000635 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 3.035 -1.165 0.058 0.00 0.00 +0.044 C ATOM 2 C LIG 1 1.617 -0.674 -0.012 0.00 0.00 -0.049 A ATOM 3 C LIG 1 0.583 -1.558 -0.344 0.00 0.00 +0.017 A ATOM 4 C LIG 1 -0.701 -1.051 -0.358 0.00 0.00 +0.049 A ATOM 5 C LIG 1 -1.968 -1.718 -0.665 0.00 0.00 +0.249 C ATOM 6 C LIG 1 -3.053 -0.619 -0.505 0.00 0.00 +0.289 C ATOM 7 N LIG 1 -2.365 0.521 -0.140 0.00 0.00 -0.278 N ATOM 8 H LIG 1 -2.825 1.401 0.036 0.00 0.00 +0.155 HD ATOM 9 O LIG 1 -4.244 -0.753 -0.668 0.00 0.00 -0.266 OA ATOM 10 O LIG 1 -2.131 -2.875 -0.976 0.00 0.00 -0.282 OA ATOM 11 C LIG 1 -0.995 0.277 -0.052 0.00 0.00 +0.048 A ATOM 12 C LIG 1 0.003 1.173 0.290 0.00 0.00 -0.028 A ATOM 13 C LIG 1 -0.289 2.599 0.634 0.00 0.00 +0.046 C ATOM 14 C LIG 1 1.319 0.673 0.312 0.00 0.00 +0.008 A ENDROOT TORSDOF 0