REMARK  Name = BDB037910
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.516  -0.136  -0.562  0.00  0.00    +0.115 A 
ATOM      2  C   LIG    1       -0.904   0.600   0.443  0.00  0.00    +0.074 A 
ATOM      3  C   LIG    1       -1.142   1.983   0.169  0.00  0.00    +0.013 A 
ATOM      4  C   LIG    1       -1.897   2.048  -1.003  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1       -2.310   3.259  -1.572  0.00  0.00    +0.026 A 
ATOM      6  C   LIG    1       -1.946   4.439  -0.918  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -1.200   4.408   0.258  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -0.794   3.189   0.813  0.00  0.00    +0.011 A 
ATOM      9  N   LIG    1       -2.110   0.756  -1.421  0.00  0.00    -0.350 N 
ATOM     10  H   LIG    1       -2.605   0.495  -2.263  0.00  0.00    +0.166 HD
ENDROOT
BRANCH   2  11
ATOM     11  C   LIG    1       -0.178  -0.002   1.549  0.00  0.00    +0.249 C 
ATOM     12  N   LIG    1        1.127   0.418   1.699  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1        2.067   0.846   0.666  0.00  0.00    +0.126 C 
ATOM     14  C   LIG    1        2.989  -0.287   1.164  0.00  0.00    +0.087 C 
ATOM     15  C   LIG    1        4.506   0.029   1.294  0.00  0.00    +0.229 C 
ATOM     16  O   LIG    1        5.055   0.976   1.839  0.00  0.00    -0.275 OA
ATOM     17  N   LIG    1        5.185  -0.971   0.670  0.00  0.00    -0.256 N 
ATOM     18  H   LIG    1        6.192  -0.999   0.621  0.00  0.00    +0.157 HD
ATOM     19  C   LIG    1        4.397  -1.932   0.110  0.00  0.00    +0.220 C 
ATOM     20  O   LIG    1        4.810  -2.909  -0.492  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        2.945  -1.588   0.352  0.00  0.00    +0.115 C 
ATOM     22  C   LIG    1        2.155  -0.283   2.463  0.00  0.00    +0.126 C 
ATOM     23  O   LIG    1       -0.698  -0.839   2.282  0.00  0.00    -0.270 OA
ENDBRANCH   2  11
BRANCH   1  26
ATOM     24  C   LIG    1       -2.581  -3.660  -1.228  0.00  0.00    +0.132 C 
ATOM     25  N   LIG    1       -2.670  -2.232  -0.978  0.00  0.00    -0.302 N 
ATOM     26  C   LIG    1       -1.456  -1.564  -0.775  0.00  0.00    +0.263 C 
ATOM     27  O   LIG    1       -0.371  -2.140  -0.825  0.00  0.00    -0.268 OA
ATOM     28  C   LIG    1       -3.898  -1.790  -0.330  0.00  0.00    +0.132 C 
ENDBRANCH   1  26
TORSDOF 2