REMARK  Name = BDB013137
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.052   0.890  -0.399  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1       -0.716   1.235  -1.545  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -2.082   1.140  -1.439  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -2.568   1.493  -2.664  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1       -1.575   1.813  -3.463  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -2.741   0.740  -0.269  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -2.029   0.428   0.781  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1       -0.404   1.648  -2.757  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -0.654   0.520   0.693  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        4.300   1.003  -0.185  0.00  0.00    +0.042 A 
ATOM     11  N   LIG    1        3.645  -0.073   0.313  0.00  0.00    -0.259 NA
ATOM     12  C   LIG    1        2.292  -0.077   0.222  0.00  0.00    +0.119 A 
ATOM     13  C   LIG    1        1.528   0.950  -0.328  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        2.233   2.041  -0.841  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        3.625   2.072  -0.768  0.00  0.00    +0.024 A 
BRANCH  10  16
ATOM     16  C   LIG    1        5.808   1.043  -0.097  0.00  0.00    +0.064 C 
BRANCH  16  17
ATOM     17  C   LIG    1        6.429  -0.229   0.482  0.00  0.00    +0.102 C 
BRANCH  17  20
ATOM     18  C   LIG    1       10.076  -1.236   0.986  0.00  0.00    +0.131 C 
ATOM     19  N   LIG    1        8.623  -1.243   1.036  0.00  0.00    -0.308 N 
ATOM     20  C   LIG    1        7.943  -0.134   0.536  0.00  0.00    +0.215 C 
ATOM     21  O   LIG    1        8.531   0.881   0.161  0.00  0.00    -0.276 OA
ATOM     22  C   LIG    1        7.999  -2.535   1.280  0.00  0.00    +0.131 C 
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH  10  16
ENDBRANCH   1  13
BRANCH   6  23
ATOM     23  N   LIG    1       -4.117   0.685  -0.259  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1       -4.632   1.233  -0.939  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.853   0.456   0.971  0.00  0.00    +0.140 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -6.322   0.366   0.652  0.00  0.00    -0.024 A 
ATOM     27  C   LIG    1       -6.887  -0.787   0.115  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -6.276  -2.108  -0.167  0.00  0.00    +0.080 C 
ATOM     29  C   LIG    1       -7.400  -2.730  -0.996  0.00  0.00    +0.234 C 
ATOM     30  O   LIG    1       -8.643  -2.060  -0.684  0.00  0.00    -0.491 OA
ATOM     31  C   LIG    1       -8.241  -0.850  -0.182  0.00  0.00    +0.124 A 
ATOM     32  C   LIG    1       -9.090   0.215   0.033  0.00  0.00    +0.046 A 
ATOM     33  C   LIG    1       -8.544   1.389   0.553  0.00  0.00    +0.004 A 
ATOM     34  C   LIG    1       -7.173   1.466   0.855  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 7