REMARK  Name = BDB051723
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.218   3.042  -0.373  0.00  0.00    +0.151 A 
ATOM      2  C   LIG    1        0.808   2.882  -0.363  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -0.320   3.856  -0.282  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -1.607   3.280  -0.925  0.00  0.00    +0.043 C 
ATOM      5  C   LIG    1       -1.818   1.810  -0.658  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1       -0.753   0.941  -0.475  0.00  0.00    +0.097 A 
ATOM      7  N   LIG    1       -0.876  -0.378  -0.270  0.00  0.00    -0.213 NA
ATOM      8  C   LIG    1       -2.121  -0.867  -0.279  0.00  0.00    +0.216 A 
ATOM      9  N   LIG    1       -3.216  -0.117  -0.467  0.00  0.00    -0.223 NA
ATOM     10  C   LIG    1       -3.047   1.204  -0.661  0.00  0.00    +0.120 A 
ATOM     11  C   LIG    1        0.580   1.521  -0.451  0.00  0.00    +0.092 A 
ATOM     12  N   LIG    1        1.813   0.938  -0.553  0.00  0.00    -0.258 N 
ATOM     13  N   LIG    1        2.817   1.842  -0.480  0.00  0.00    -0.165 NA
ENDROOT
BRANCH  12  14
ATOM     14  C   LIG    1        2.130  -0.475  -0.735  0.00  0.00    +0.110 C 
ATOM     15  C   LIG    1        3.376  -0.723  -1.597  0.00  0.00    +0.042 C 
ATOM     16  C   LIG    1        3.628  -2.222  -1.744  0.00  0.00    +0.086 C 
ATOM     17  N   LIG    1        3.761  -2.870  -0.432  0.00  0.00    -0.305 NA
ATOM     18  C   LIG    1        4.050  -4.295  -0.591  0.00  0.00    +0.104 C 
ATOM     19  C   LIG    1        2.566  -2.672   0.396  0.00  0.00    +0.086 C 
ATOM     20  C   LIG    1        2.281  -1.188   0.611  0.00  0.00    +0.042 C 
ENDBRANCH  12  14
BRANCH   1  24
ATOM     21  C   LIG    1        3.224   6.404   0.934  0.00  0.00    +0.128 C 
ATOM     22  N   LIG    1        2.475   5.218   0.607  0.00  0.00    -0.313 N 
ATOM     23  H   LIG    1        1.817   4.868   1.290  0.00  0.00    +0.149 HD
ATOM     24  C   LIG    1        3.004   4.286  -0.274  0.00  0.00    +0.264 C 
ATOM     25  O   LIG    1        4.045   4.484  -0.895  0.00  0.00    -0.268 OA
ENDBRANCH   1  24
BRANCH   8  26
ATOM     26  N   LIG    1       -2.211  -2.227  -0.068  0.00  0.00    -0.311 N 
ATOM     27  H   LIG    1       -1.325  -2.514   0.333  0.00  0.00    +0.149 HD
BRANCH  26  28
ATOM     28  C   LIG    1       -3.385  -2.838   0.530  0.00  0.00    +0.073 C 
ATOM     29  C   LIG    1       -3.873  -2.179   1.829  0.00  0.00    +0.022 C 
ATOM     30  C   LIG    1       -5.329  -1.801   1.570  0.00  0.00    +0.002 C 
ATOM     31  C   LIG    1       -5.792  -2.794   0.517  0.00  0.00    +0.002 C 
ATOM     32  C   LIG    1       -4.592  -2.913  -0.411  0.00  0.00    +0.022 C 
ENDBRANCH  26  28
ENDBRANCH   8  26
TORSDOF 4