REMARK  Name = BDB014073
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.630  -0.549   0.477  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1        1.801   0.375  -0.336  0.00  0.00    +0.104 C 
ATOM      3  C   LIG    1        0.349  -0.104  -0.537  0.00  0.00    +0.123 C 
ATOM      4  N   LIG    1       -0.347  -0.225   0.759  0.00  0.00    -0.299 N 
ATOM      5  C   LIG    1        0.506  -0.575   1.900  0.00  0.00    +0.123 C 
ATOM      6  C   LIG    1        1.802  -1.286   1.451  0.00  0.00    +0.104 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -1.726  -0.189   0.794  0.00  0.00    +0.200 A 
ATOM      8  N   LIG    1       -2.333  -0.098   2.013  0.00  0.00    -0.295 N 
ATOM      9  H   LIG    1       -1.792  -0.006   2.853  0.00  0.00    +0.172 HD
ATOM     10  C   LIG    1       -3.680  -0.027   2.167  0.00  0.00    +0.258 A 
ATOM     11  O   LIG    1       -4.198   0.080   3.275  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -4.466  -0.092   0.926  0.00  0.00    +0.057 A 
ATOM     13  C   LIG    1       -5.959  -0.029   1.046  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -6.636   0.263  -0.290  0.00  0.00    +0.024 C 
ATOM     15  C   LIG    1       -5.987  -0.545  -1.404  0.00  0.00    +0.106 C 
ATOM     16  N   LIG    1       -4.549  -0.265  -1.436  0.00  0.00    -0.318 N 
ATOM     17  C   LIG    1       -3.879  -0.583  -2.695  0.00  0.00    +0.130 C 
ATOM     18  C   LIG    1       -3.804  -0.194  -0.245  0.00  0.00    +0.133 A 
ATOM     19  N   LIG    1       -2.430  -0.230  -0.295  0.00  0.00    -0.200 NA
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1        3.731   0.179   1.142  0.00  0.00    +0.140 C 
BRANCH  20  23
ATOM     21  C   LIG    1        5.575  -1.362  -0.690  0.00  0.00    +0.045 C 
ATOM     22  C   LIG    1        5.561   0.138  -0.650  0.00  0.00    -0.028 A 
ATOM     23  C   LIG    1        4.703   0.863   0.191  0.00  0.00    +0.058 A 
ATOM     24  N   LIG    1        4.670   2.225   0.201  0.00  0.00    -0.258 NA
ATOM     25  C   LIG    1        5.498   2.881  -0.638  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1        6.370   2.251  -1.504  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        6.396   0.862  -1.510  0.00  0.00    +0.006 A 
ENDBRANCH  20  23
ENDBRANCH   1  20
TORSDOF 3