REMARK  Name = BDB014060
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.223   1.110  -0.720  0.00  0.00    -0.290 NA
ATOM      2  C   LIG    1        1.534   1.206   0.586  0.00  0.00    +0.104 C 
ATOM      3  C   LIG    1       -0.001   1.145   0.444  0.00  0.00    +0.123 C 
ATOM      4  N   LIG    1       -0.425  -0.081  -0.273  0.00  0.00    -0.299 N 
ATOM      5  C   LIG    1        0.276  -0.218  -1.568  0.00  0.00    +0.123 C 
ATOM      6  C   LIG    1        1.808  -0.140  -1.387  0.00  0.00    +0.104 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -1.759  -0.440  -0.176  0.00  0.00    +0.200 A 
ATOM      8  N   LIG    1       -2.096  -1.672  -0.651  0.00  0.00    -0.295 N 
ATOM      9  H   LIG    1       -1.377  -2.304  -0.956  0.00  0.00    +0.172 HD
ATOM     10  C   LIG    1       -3.348  -2.187  -0.547  0.00  0.00    +0.258 A 
ATOM     11  O   LIG    1       -3.606  -3.341  -0.876  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -4.364  -1.272  -0.005  0.00  0.00    +0.057 A 
ATOM     13  C   LIG    1       -5.782  -1.756   0.034  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -6.774  -0.622   0.274  0.00  0.00    +0.024 C 
ATOM     15  C   LIG    1       -6.254   0.321   1.350  0.00  0.00    +0.106 C 
ATOM     16  N   LIG    1       -4.928   0.814   0.969  0.00  0.00    -0.318 N 
ATOM     17  C   LIG    1       -4.504   2.043   1.635  0.00  0.00    +0.130 C 
ATOM     18  C   LIG    1       -3.965  -0.059   0.430  0.00  0.00    +0.133 A 
ATOM     19  N   LIG    1       -2.648   0.334   0.362  0.00  0.00    -0.200 NA
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1        3.703   1.265  -0.573  0.00  0.00    +0.125 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.426   0.164   0.218  0.00  0.00    +0.146 A 
ATOM     22  N   LIG    1        4.723  -0.997  -0.408  0.00  0.00    -0.239 NA
ATOM     23  C   LIG    1        5.337  -1.940   0.331  0.00  0.00    +0.114 A 
ATOM     24  C   LIG    1        5.658  -1.778   1.656  0.00  0.00    +0.039 A 
ATOM     25  C   LIG    1        5.312  -0.567   2.205  0.00  0.00    +0.114 A 
ATOM     26  N   LIG    1        4.699   0.414   1.518  0.00  0.00    -0.239 NA
ENDBRANCH  20  21
BRANCH  20  28
ATOM     27  C   LIG    1        5.793   2.019  -1.852  0.00  0.00    +0.006 C 
ATOM     28  C   LIG    1        4.357   1.511  -1.954  0.00  0.00    +0.023 C 
ENDBRANCH  20  28
ENDBRANCH   1  20
TORSDOF 4