REMARK  Name = BDB014838
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.622   0.353   0.056  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.840   1.329   0.213  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -7.152   2.414   0.947  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.649   2.401   0.835  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -5.052   1.234   0.373  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.589   1.296   0.190  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -3.014  -0.067   0.044  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.665  -0.510  -0.027  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -1.622  -1.839  -0.182  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.903  -2.241  -0.187  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -3.194  -3.648  -0.315  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.777  -1.208  -0.078  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -5.256  -1.244  -0.060  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.787   0.176  -0.356  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -4.996   3.394   1.156  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        0.775   0.148  -0.011  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        1.373  -1.095  -0.225  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        2.767  -1.233  -0.284  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        3.616  -0.129  -0.129  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1        3.018   1.120   0.087  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        1.625   1.255   0.144  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        5.076  -0.274  -0.192  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        5.709  -0.929  -1.249  0.00  0.00    +0.119 A 
ATOM     24  N   LIG    1        7.050  -1.100  -1.368  0.00  0.00    -0.260 NA
ATOM     25  C   LIG    1        7.827  -0.594  -0.385  0.00  0.00    +0.038 A 
ATOM     26  C   LIG    1        9.309  -0.782  -0.511  0.00  0.00    +0.065 C 
ATOM     27  C   LIG    1        7.299   0.078   0.712  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1        5.915   0.237   0.804  0.00  0.00    +0.012 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 3