REMARK  Name = BDB053467
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.043  -0.498  -0.225  0.00  0.00    +0.166 A 
ATOM      2  C   LIG    1        1.283  -0.022   0.166  0.00  0.00    +0.179 A 
ATOM      3  N   LIG    1        2.413  -0.611  -0.348  0.00  0.00    -0.295 N 
ATOM      4  C   LIG    1        3.485   0.054   0.206  0.00  0.00    +0.076 A 
ATOM      5  C   LIG    1        2.917   1.013   1.027  0.00  0.00    +0.140 A 
ATOM      6  C   LIG    1        2.281  -1.659  -1.238  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1        1.044  -2.061  -1.568  0.00  0.00    +0.131 A 
ATOM      8  N   LIG    1        1.546   0.964   0.999  0.00  0.00    -0.232 NA
ATOM      9  N   LIG    1       -0.116  -1.496  -1.075  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   4  10
ATOM     10  C   LIG    1        5.008  -0.159   0.009  0.00  0.00    +0.038 A 
ATOM     11  C   LIG    1        5.646  -1.083  -0.782  0.00  0.00    +0.118 A 
ATOM     12  N   LIG    1        6.986  -0.866  -0.611  0.00  0.00    -0.274 N 
ATOM     13  C   LIG    1        8.071  -1.586  -1.234  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        7.263   0.139   0.238  0.00  0.00    -0.179 NA
ATOM     15  C   LIG    1        6.056   0.568   0.615  0.00  0.00    +0.144 A 
ENDBRANCH   4  10
BRANCH   1  16
ATOM     16  N   LIG    1       -1.135   0.140   0.329  0.00  0.00    -0.296 N 
ATOM     17  H   LIG    1       -0.883   0.886   0.970  0.00  0.00    +0.154 HD
BRANCH  16  20
ATOM     18  C   LIG    1       -4.809   0.654   0.820  0.00  0.00    +0.031 A 
ATOM     19  C   LIG    1       -3.404   0.770   0.878  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1       -2.514  -0.095   0.200  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1       -3.067  -1.117  -0.565  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -4.448  -1.281  -0.635  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -5.300  -0.412   0.053  0.00  0.00    +0.023 A 
BRANCH  18  25
ATOM     24  C   LIG    1       -5.148   2.854   1.866  0.00  0.00    +0.129 C 
ATOM     25  N   LIG    1       -5.653   1.525   1.523  0.00  0.00    -0.336 N 
ATOM     26  C   LIG    1       -7.098   1.437   1.319  0.00  0.00    +0.129 C 
ENDBRANCH  18  25
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 4