REMARK  Name = BDB001474
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.745  -1.825   1.267  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1       -0.135  -1.182   0.320  0.00  0.00    -0.264 N 
ATOM      3  C   LIG    1        0.162  -0.166  -0.538  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        1.403   0.550  -0.760  0.00  0.00    +0.097 A 
ATOM      5  C   LIG    1        1.344   1.686  -1.553  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1        0.036   2.227  -2.078  0.00  0.00    +0.043 C 
ATOM      7  C   LIG    1       -1.070   1.158  -2.277  0.00  0.00    +0.044 C 
ATOM      8  C   LIG    1        2.549   2.312  -1.728  0.00  0.00    +0.120 A 
ATOM      9  N   LIG    1        3.702   1.853  -1.203  0.00  0.00    -0.222 NA
ATOM     10  C   LIG    1        3.657   0.734  -0.460  0.00  0.00    +0.220 A 
ATOM     11  N   LIG    1        2.524   0.056  -0.212  0.00  0.00    -0.212 NA
ATOM     12  C   LIG    1       -1.007   0.111  -1.218  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -1.970  -0.797  -0.715  0.00  0.00    +0.151 A 
ATOM     14  N   LIG    1       -1.426  -1.585   0.241  0.00  0.00    -0.166 NA
ENDROOT
BRANCH  13  15
ATOM     15  C   LIG    1       -3.381  -0.935  -1.115  0.00  0.00    +0.265 C 
ATOM     16  N   LIG    1       -4.039  -1.927  -0.426  0.00  0.00    -0.306 N 
ATOM     17  H   LIG    1       -3.507  -2.344   0.332  0.00  0.00    +0.149 HD
ATOM     18  O   LIG    1       -3.907  -0.229  -1.971  0.00  0.00    -0.268 OA
BRANCH  16  19
ATOM     19  C   LIG    1       -5.461  -2.124  -0.507  0.00  0.00    +0.140 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -6.169  -1.426   0.624  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1       -6.455  -2.104   1.818  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1       -7.094  -1.445   2.870  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -7.444  -0.102   2.743  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -7.154   0.585   1.566  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.517  -0.072   0.513  0.00  0.00    +0.005 A 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH  13  15
BRANCH  10  26
ATOM     26  N   LIG    1        4.800   0.187   0.117  0.00  0.00    -0.284 N 
ATOM     27  H   LIG    1        4.547  -0.654   0.612  0.00  0.00    +0.155 HD
BRANCH  26  28
ATOM     28  C   LIG    1        6.154   0.536   0.120  0.00  0.00    +0.034 A 
ATOM     29  C   LIG    1        7.055  -0.282   0.825  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1        8.422   0.009   0.873  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1        8.916   1.129   0.215  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        8.043   1.954  -0.487  0.00  0.00    +0.002 A 
ATOM     33  C   LIG    1        6.676   1.658  -0.532  0.00  0.00    +0.023 A 
ENDBRANCH  26  28
ENDBRANCH  10  26
TORSDOF 5