REMARK  Name = BDB051345
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.008   3.418  -0.886  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1       -4.601   2.290  -0.623  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1       -5.380   1.087  -0.766  0.00  0.00    +0.112 A 
ATOM      4  N   LIG    1       -4.868  -0.153  -0.455  0.00  0.00    -0.310 N 
ATOM      5  C   LIG    1       -5.834  -1.104  -0.690  0.00  0.00    +0.092 A 
ATOM      6  C   LIG    1       -6.966  -0.467  -1.153  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -3.550  -0.317   0.022  0.00  0.00    +0.070 A 
ATOM      8  C   LIG    1       -2.781   0.846   0.165  0.00  0.00    +0.066 A 
ATOM      9  C   LIG    1       -1.468   0.763   0.630  0.00  0.00    +0.032 A 
ATOM     10  C   LIG    1       -0.914  -0.486   0.951  0.00  0.00    -0.032 A 
ATOM     11  C   LIG    1       -1.700  -1.642   0.807  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1       -3.016  -1.565   0.342  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1       -6.681   0.916  -1.202  0.00  0.00    +0.033 A 
ATOM     14  N   LIG    1       -3.319   2.102  -0.156  0.00  0.00    -0.319 N 
ATOM     15  H   LIG    1       -2.768   2.942  -0.051  0.00  0.00    +0.169 HD
ENDROOT
BRANCH  10  16
ATOM     16  C   LIG    1        0.505  -0.585   1.466  0.00  0.00    +0.116 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.348  -1.499   0.689  0.00  0.00    -0.311 NA
ATOM     18  H   LIG    1        2.251  -1.546   1.174  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.663  -0.988  -0.657  0.00  0.00    +0.096 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.703   0.161  -0.661  0.00  0.00    +0.099 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.810  -0.058   0.300  0.00  0.00    -0.301 NA
ATOM     22  C   LIG    1        4.755  -1.089  -0.163  0.00  0.00    +0.084 C 
ATOM     23  C   LIG    1        5.733  -0.384  -1.093  0.00  0.00    +0.017 C 
ATOM     24  C   LIG    1        5.641   1.090  -0.725  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1        4.648   1.146   0.426  0.00  0.00    +0.084 C 
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  10  16
TORSDOF 5