REMARK  Name = BDB008893
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.090  -0.634   2.224  0.00  0.00    +0.092 C 
ENDROOT
BRANCH   1  10
ATOM      2  O   LIG    1       -4.374  -3.151  -1.420  0.00  0.00    -0.266 OA
ATOM      3  C   LIG    1       -3.678  -2.543  -0.613  0.00  0.00    +0.268 A 
ATOM      4  C   LIG    1       -3.915  -1.113  -0.296  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1       -5.040  -0.442  -1.034  0.00  0.00    +0.041 C 
ATOM      6  C   LIG    1       -5.024   1.082  -0.896  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1       -4.716   1.499   0.536  0.00  0.00    +0.005 C 
ATOM      8  C   LIG    1       -3.359   0.952   0.989  0.00  0.00    +0.037 C 
ATOM      9  C   LIG    1       -3.140  -0.484   0.606  0.00  0.00    -0.016 A 
ATOM     10  C   LIG    1       -2.039  -1.290   1.224  0.00  0.00    +0.069 A 
ATOM     11  N   LIG    1       -1.821  -2.543   0.954  0.00  0.00    -0.175 NA
ATOM     12  N   LIG    1       -2.643  -3.141   0.053  0.00  0.00    -0.243 N 
ATOM     13  H   LIG    1       -2.466  -4.119  -0.148  0.00  0.00    +0.192 HD
ENDBRANCH   1  10
BRANCH   1  14
ATOM     14  C   LIG    1       -0.103   0.316   1.587  0.00  0.00    -0.041 A 
ATOM     15  C   LIG    1        0.680  -0.089   0.495  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        1.612   0.782  -0.090  0.00  0.00    -0.033 A 
ATOM     17  C   LIG    1        1.759   2.071   0.440  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1        1.000   2.477   1.536  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        0.078   1.603   2.111  0.00  0.00    +0.004 A 
BRANCH  16  20
ATOM     20  C   LIG    1        2.447   0.338  -1.272  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.886   0.355  -0.995  0.00  0.00    -0.298 NA
ATOM     22  C   LIG    1        4.293  -0.645  -0.005  0.00  0.00    +0.085 C 
ATOM     23  C   LIG    1        5.803  -0.709  -0.184  0.00  0.00    +0.017 C 
ATOM     24  C   LIG    1        6.054  -0.260  -1.619  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1        4.676   0.044  -2.187  0.00  0.00    +0.085 C 
ENDBRANCH  20  21
ENDBRANCH  16  20
ENDBRANCH   1  14
TORSDOF 4