REMARK  Name = BDB056523
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        6.606   1.298  -2.232  0.00  0.00    -0.311 N 
ATOM      2  H   LIG    1        7.322   0.588  -2.277  0.00  0.00    +0.147 HD
ATOM      3  H   LIG    1        6.452   1.833  -3.078  0.00  0.00    +0.147 HD
ATOM      4  C   LIG    1        5.508   1.184  -1.420  0.00  0.00    +0.317 C 
ATOM      5  N   LIG    1        5.685   0.293  -0.336  0.00  0.00    -0.255 N 
ATOM      6  C   LIG    1        4.682  -0.171   0.511  0.00  0.00    +0.149 A 
ATOM      7  C   LIG    1        5.256  -1.008   1.465  0.00  0.00    +0.019 A 
ATOM      8  C   LIG    1        4.410  -1.577   2.427  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1        3.049  -1.276   2.357  0.00  0.00    +0.029 A 
ATOM     10  C   LIG    1        2.564  -0.442   1.347  0.00  0.00    +0.073 A 
ATOM     11  C   LIG    1        6.642  -1.066   1.200  0.00  0.00    +0.030 A 
ATOM     12  N   LIG    1        3.369   0.123   0.417  0.00  0.00    -0.229 NA
ATOM     13  C   LIG    1        6.884  -0.268   0.106  0.00  0.00    +0.098 A 
ATOM     14  O   LIG    1        4.465   1.786  -1.621  0.00  0.00    -0.249 OA
ENDROOT
BRANCH  10  15
ATOM     15  C   LIG    1        1.127  -0.095   1.222  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        0.733   1.119   0.627  0.00  0.00    +0.010 A 
ATOM     17  C   LIG    1       -0.615   1.475   0.498  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -1.622   0.618   0.953  0.00  0.00    -0.033 A 
ATOM     19  C   LIG    1       -1.249  -0.593   1.547  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1        0.101  -0.946   1.671  0.00  0.00    +0.010 A 
BRANCH  18  21
ATOM     21  C   LIG    1       -3.080   1.012   0.835  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.929  -0.037   0.247  0.00  0.00    -0.298 NA
ATOM     23  C   LIG    1       -5.346   0.230   0.528  0.00  0.00    +0.085 C 
ATOM     24  C   LIG    1       -6.266  -0.642  -0.322  0.00  0.00    +0.015 C 
ATOM     25  C   LIG    1       -6.085  -0.361  -1.812  0.00  0.00    +0.002 C 
ATOM     26  C   LIG    1       -4.719   0.246  -2.125  0.00  0.00    +0.015 C 
ATOM     27  C   LIG    1       -3.641  -0.277  -1.177  0.00  0.00    +0.085 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  10  15
TORSDOF 3