REMARK  Name = BDB028375
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.099   0.954  -1.617  0.00  0.00    +0.078 A 
ATOM      2  N   LIG    1        1.904   1.153  -2.720  0.00  0.00    -0.266 N 
ATOM      3  C   LIG    1        3.220   0.603  -2.952  0.00  0.00    +0.173 C 
ATOM      4  N   LIG    1        1.371   1.986  -3.635  0.00  0.00    -0.179 NA
ATOM      5  C   LIG    1        0.185   2.310  -3.119  0.00  0.00    +0.143 A 
ATOM      6  C   LIG    1       -0.045   1.698  -1.870  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   6   7
ATOM      7  C   LIG    1       -1.177   1.813  -0.976  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1       -1.931   0.678  -0.645  0.00  0.00    +0.019 A 
ATOM      9  C   LIG    1       -3.003   0.778   0.248  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1       -3.323   2.016   0.798  0.00  0.00    +0.050 A 
ATOM     11  C   LIG    1       -4.437   2.107   1.755  0.00  0.00    +0.272 A 
ATOM     12  N   LIG    1       -5.085   0.931   2.044  0.00  0.00    -0.242 N 
ATOM     13  H   LIG    1       -5.854   0.974   2.706  0.00  0.00    +0.192 HD
ATOM     14  N   LIG    1       -4.799  -0.293   1.522  0.00  0.00    -0.174 NA
ATOM     15  O   LIG    1       -4.757   3.177   2.261  0.00  0.00    -0.266 OA
ATOM     16  C   LIG    1       -2.591   3.159   0.455  0.00  0.00    +0.014 A 
ATOM     17  C   LIG    1       -3.824  -0.386   0.664  0.00  0.00    +0.083 A 
ATOM     18  C   LIG    1       -1.519   3.057  -0.434  0.00  0.00    +0.009 A 
BRANCH  17  19
ATOM     19  C   LIG    1       -3.528  -1.768   0.087  0.00  0.00    +0.136 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -2.342  -2.322   0.747  0.00  0.00    -0.325 NA
ATOM     21  H   LIG    1       -2.554  -2.420   1.743  0.00  0.00    +0.119 HD
ATOM     22  H   LIG    1       -2.201  -3.273   0.405  0.00  0.00    +0.119 HD
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   6   7
BRANCH   1  25
ATOM     23  C   LIG    1        1.712  -1.922   0.797  0.00  0.00    -0.026 A 
ATOM     24  C   LIG    1        1.317  -1.228  -0.367  0.00  0.00    +0.064 A 
ATOM     25  C   LIG    1        1.493   0.169  -0.442  0.00  0.00    +0.022 A 
ATOM     26  C   LIG    1        2.051   0.865   0.646  0.00  0.00    +0.057 A 
ATOM     27  C   LIG    1        2.447   0.185   1.795  0.00  0.00    +0.121 A 
ATOM     28  C   LIG    1        2.283  -1.199   1.859  0.00  0.00    +0.050 A 
BRANCH  23  30
ATOM     29  C   LIG    1        2.767  -4.167   0.380  0.00  0.00    +0.009 C 
ATOM     30  C   LIG    1        1.567  -3.421   0.944  0.00  0.00    +0.033 C 
ENDBRANCH  23  30
BRANCH  24  31
ATOM     31  C   LIG    1        0.733  -1.943  -1.470  0.00  0.00    +0.100 C 
ATOM     32  N   LIG    1        0.270  -2.534  -2.357  0.00  0.00    -0.191 NA
ENDBRANCH  24  31
BRANCH  27  33
ATOM     33  O   LIG    1        3.006   0.746   2.909  0.00  0.00    -0.495 OA
ATOM     34  C   LIG    1        3.102   2.165   2.941  0.00  0.00    +0.277 C 
ENDBRANCH  27  33
ENDBRANCH   1  25
TORSDOF 7