REMARK  Name = BDB005134
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.931  -0.248   0.491  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1        1.964   0.461  -0.160  0.00  0.00    +0.041 A 
ATOM      3  C   LIG    1        3.162   0.639   0.559  0.00  0.00    +0.088 A 
ATOM      4  C   LIG    1        4.200   1.356  -0.071  0.00  0.00    +0.063 A 
ATOM      5  C   LIG    1        4.052   1.868  -1.375  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        2.875   1.674  -2.079  0.00  0.00    +0.002 A 
ATOM      7  N   LIG    1        3.290   0.129   1.805  0.00  0.00    -0.235 NA
ATOM      8  C   LIG    1        2.256  -0.548   2.316  0.00  0.00    +0.223 A 
ATOM      9  C   LIG    1        1.840   0.974  -1.476  0.00  0.00    +0.013 A 
ATOM     10  N   LIG    1        1.085  -0.761   1.721  0.00  0.00    -0.220 NA
ENDROOT
BRANCH   4  11
ATOM     11  C   LIG    1        5.522   1.627   0.578  0.00  0.00    +0.244 C 
ATOM     12  O   LIG    1        6.409   2.246  -0.002  0.00  0.00    -0.270 OA
ATOM     13  N   LIG    1        5.732   1.170   1.845  0.00  0.00    -0.325 N 
ATOM     14  H   LIG    1        5.017   0.637   2.331  0.00  0.00    +0.145 HD
ATOM     15  H   LIG    1        6.626   1.332   2.284  0.00  0.00    +0.145 HD
ENDBRANCH   4  11
BRANCH   1  16
ATOM     16  N   LIG    1       -0.298  -0.439  -0.175  0.00  0.00    -0.322 N 
ATOM     17  H   LIG    1       -0.656   0.478  -0.435  0.00  0.00    +0.148 HD
BRANCH  16  19
ATOM     18  C   LIG    1       -1.076  -2.707   0.418  0.00  0.00    +0.033 C 
ATOM     19  C   LIG    1       -1.334  -1.201   0.533  0.00  0.00    +0.099 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.684  -0.840  -0.078  0.00  0.00    -0.026 A 
ATOM     21  C   LIG    1       -3.675  -0.236   0.716  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1       -4.928   0.095   0.190  0.00  0.00    +0.025 A 
ATOM     23  C   LIG    1       -5.151  -0.086  -1.177  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -4.180  -0.679  -1.984  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -2.956  -1.061  -1.437  0.00  0.00    +0.005 A 
BRANCH  22  26
ATOM     26  N   LIG    1       -5.854   0.800   0.967  0.00  0.00    -0.358 N 
ATOM     27  H   LIG    1       -5.782   0.614   1.962  0.00  0.00    +0.142 HD
ATOM     28  H   LIG    1       -6.810   0.726   0.631  0.00  0.00    +0.142 HD
ENDBRANCH  22  26
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 5