REMARK  Name = BDB019758
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.579  -1.402   1.708  0.00  0.00    +0.125 A 
ATOM      2  C   LIG    1       -3.003  -0.244   1.029  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -2.098   0.816   0.839  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1       -0.789   0.734   1.323  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.384  -0.407   2.021  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1       -1.274  -1.470   2.208  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        0.130   1.882   1.096  0.00  0.00    +0.245 C 
ATOM      8  N   LIG    1        1.464   1.567   0.954  0.00  0.00    -0.305 N 
ATOM      9  H   LIG    1        1.722   0.601   0.805  0.00  0.00    +0.150 HD
ATOM     10  O   LIG    1       -0.314   3.020   1.012  0.00  0.00    -0.270 OA
BRANCH   8  11
ATOM     11  C   LIG    1        2.456   2.580   0.632  0.00  0.00    +0.101 C 
ATOM     12  C   LIG    1        2.782   3.454   1.847  0.00  0.00    +0.033 C 
BRANCH  11  13
ATOM     13  C   LIG    1        3.696   1.912   0.066  0.00  0.00    -0.021 A 
ATOM     14  C   LIG    1        4.519   1.095   0.854  0.00  0.00    +0.051 A 
ATOM     15  C   LIG    1        5.646   0.468   0.314  0.00  0.00    +0.124 A 
ATOM     16  C   LIG    1        5.958   0.648  -1.035  0.00  0.00    +0.091 A 
ATOM     17  C   LIG    1        5.147   1.453  -1.840  0.00  0.00    +0.124 A 
ATOM     18  C   LIG    1        4.024   2.077  -1.287  0.00  0.00    +0.051 A 
BRANCH  15  19
ATOM     19  O   LIG    1        6.348  -0.295   1.208  0.00  0.00    -0.495 OA
ATOM     20  C   LIG    1        7.543  -0.907   0.740  0.00  0.00    +0.277 C 
ENDBRANCH  15  19
BRANCH  17  21
ATOM     21  O   LIG    1        5.334   1.707  -3.172  0.00  0.00    -0.495 OA
ATOM     22  C   LIG    1        6.465   1.111  -3.795  0.00  0.00    +0.277 C 
ENDBRANCH  17  21
ENDBRANCH  11  13
ENDBRANCH   8  11
ENDBRANCH   4   7
BRANCH   1  23
ATOM     23  O   LIG    1       -3.506  -2.403   1.815  0.00  0.00    -0.492 OA
BRANCH  23  25
ATOM     24  C   LIG    1       -4.348  -4.498   2.572  0.00  0.00    +0.048 C 
ATOM     25  C   LIG    1       -3.151  -3.565   2.562  0.00  0.00    +0.225 C 
ENDBRANCH  23  25
ENDBRANCH   1  23
BRANCH   2  26
ATOM     26  C   LIG    1       -4.400  -0.127   0.457  0.00  0.00    +0.143 C 
BRANCH  26  27
ATOM     27  N   LIG    1       -4.417  -0.695  -0.879  0.00  0.00    -0.313 N 
ATOM     28  H   LIG    1       -3.991  -1.614  -0.897  0.00  0.00    +0.149 HD
BRANCH  27  29
ATOM     29  C   LIG    1       -5.551  -0.650  -1.612  0.00  0.00    +0.176 C 
ATOM     30  N   LIG    1       -5.494  -1.394  -2.749  0.00  0.00    -0.316 N 
ATOM     31  H   LIG    1       -4.602  -1.318  -3.223  0.00  0.00    +0.149 HD
ATOM     32  C   LIG    1       -6.644  -1.024  -3.548  0.00  0.00    +0.127 C 
ATOM     33  C   LIG    1       -7.527  -0.323  -2.510  0.00  0.00    +0.163 C 
ATOM     34  N   LIG    1       -6.634   0.024  -1.371  0.00  0.00    -0.255 NA
ENDBRANCH  27  29
ENDBRANCH  26  27
ENDBRANCH   2  26
TORSDOF 10