REMARK  Name = BDB051283
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.691   0.172   0.721  0.00  0.00    +0.095 A 
ATOM      2  N   LIG    1       -1.553  -0.243  -0.228  0.00  0.00    -0.164 NA
ATOM      3  N   LIG    1       -2.772   0.049   0.261  0.00  0.00    -0.215 N 
ATOM      4  C   LIG    1       -2.724   0.638   1.497  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1       -3.868   1.011   2.164  0.00  0.00    -0.307 N 
ATOM      6  H   LIG    1       -3.831   1.446   3.078  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1       -5.113   0.800   1.603  0.00  0.00    +0.259 A 
ATOM      8  C   LIG    1       -5.160   0.158   0.254  0.00  0.00    +0.065 A 
ATOM      9  C   LIG    1       -6.391  -0.080  -0.365  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -6.429  -0.682  -1.627  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1       -5.243  -1.046  -2.273  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -4.009  -0.813  -1.665  0.00  0.00    +0.028 A 
ATOM     13  O   LIG    1       -6.139   1.128   2.187  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1       -3.978  -0.212  -0.404  0.00  0.00    +0.080 A 
ATOM     15  C   LIG    1       -1.397   0.734   1.828  0.00  0.00    +0.076 A 
ENDROOT
BRANCH   1  19
ATOM     16  C   LIG    1        3.555  -0.281   0.209  0.00  0.00    -0.047 A 
ATOM     17  C   LIG    1        2.663  -0.781  -0.745  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        1.284  -0.631  -0.572  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        0.761   0.024   0.553  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        1.662   0.530   1.502  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        3.043   0.381   1.330  0.00  0.00    +0.004 A 
BRANCH  16  22
ATOM     22  C   LIG    1        5.044  -0.425   0.016  0.00  0.00    +0.035 C 
BRANCH  22  24
ATOM     23  C   LIG    1        7.132   0.608  -0.945  0.00  0.00    +0.004 C 
ATOM     24  C   LIG    1        5.631   0.759  -0.754  0.00  0.00    +0.001 C 
ENDBRANCH  22  24
ENDBRANCH  16  22
ENDBRANCH   1  19
TORSDOF 3