REMARK  Name = BDB014834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.031   0.390   0.118  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.377   1.332   0.235  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -4.893   3.068  -0.440  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.464   1.720  -0.071  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.562   0.680   0.119  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.109   0.913   0.260  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.347  -0.350   0.081  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -0.949  -0.605   0.017  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -0.722  -1.913  -0.146  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -1.938  -2.484  -0.199  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.035  -3.910  -0.389  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -2.943  -1.586  -0.044  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.405  -1.829  -0.029  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.095  -0.608   0.612  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -6.682   1.578   0.036  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.382   0.369   0.085  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        2.076   1.583   0.212  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        3.477   1.631   0.187  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        4.239   0.464   0.033  0.00  0.00    -0.015 A 
ATOM     20  C   LIG    1        3.545  -0.747  -0.094  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        2.143  -0.791  -0.067  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        5.704   0.509   0.003  0.00  0.00    +0.018 A 
ATOM     23  C   LIG    1        6.462   1.198   0.936  0.00  0.00    +0.122 A 
ATOM     24  N   LIG    1        7.812   1.264   0.934  0.00  0.00    -0.243 NA
ATOM     25  C   LIG    1        8.422   0.596  -0.055  0.00  0.00    +0.221 A 
ATOM     26  N   LIG    1        7.814  -0.110  -1.018  0.00  0.00    -0.243 NA
ATOM     27  C   LIG    1        6.464  -0.133  -0.962  0.00  0.00    +0.122 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 3