REMARK  Name = BDB035109
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.617   1.271  -1.745  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1       -0.191   2.416  -2.215  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1       -1.529   2.621  -1.464  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1       -2.358   1.405  -1.459  0.00  0.00    -0.293 NA
ATOM      5  C   LIG    1       -1.592   0.243  -0.971  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1       -0.250   0.071  -1.724  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.661   1.607  -0.793  0.00  0.00    +0.084 C 
ATOM      8  C   LIG    1       -3.593   1.974   0.735  0.00  0.00    +0.051 C 
ATOM      9  C   LIG    1       -4.633   1.334   1.617  0.00  0.00    -0.012 C 
ATOM     10  C   LIG    1       -5.446   0.383   1.146  0.00  0.00    +0.037 C 
ATOM     11  C   LIG    1       -5.408  -0.079  -0.215  0.00  0.00    -0.021 C 
ATOM     12  C   LIG    1       -6.426  -1.169  -0.345  0.00  0.00    +0.143 C 
ATOM     13  N   LIG    1       -7.034  -1.228   0.974  0.00  0.00    -0.296 N 
ATOM     14  C   LIG    1       -8.075  -2.177   1.283  0.00  0.00    +0.132 C 
ATOM     15  C   LIG    1       -6.488  -0.353   1.899  0.00  0.00    +0.247 C 
ATOM     16  O   LIG    1       -6.774  -0.203   3.071  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1       -4.603   0.468  -1.134  0.00  0.00    -0.002 C 
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  C   LIG    1        1.231   1.553  -0.437  0.00  0.00    +0.121 C 
BRANCH  18  28
ATOM     19  C   LIG    1        6.502  -2.242   0.505  0.00  0.00    +0.081 C 
ATOM     20  C   LIG    1        6.377  -1.882  -0.969  0.00  0.00    +0.221 C 
ATOM     21  O   LIG    1        7.229  -2.209  -1.793  0.00  0.00    -0.275 OA
ATOM     22  N   LIG    1        5.324  -1.094  -1.342  0.00  0.00    -0.284 N 
ATOM     23  H   LIG    1        5.327  -0.781  -2.305  0.00  0.00    +0.155 HD
ATOM     24  C   LIG    1        4.280  -0.725  -0.491  0.00  0.00    +0.055 A 
ATOM     25  C   LIG    1        4.177  -1.269   0.785  0.00  0.00    +0.063 A 
ATOM     26  N   LIG    1        3.187  -0.942   1.650  0.00  0.00    -0.258 NA
ATOM     27  C   LIG    1        2.273  -0.041   1.220  0.00  0.00    +0.116 A 
ATOM     28  C   LIG    1        2.281   0.544  -0.043  0.00  0.00    -0.014 A 
ATOM     29  C   LIG    1        3.320   0.188  -0.911  0.00  0.00    +0.031 A 
ATOM     30  C   LIG    1        5.143  -2.340   1.204  0.00  0.00    +0.070 C 
BRANCH  19  32
ATOM     31  C   LIG    1        7.107   0.125   1.404  0.00  0.00    +0.004 C 
ATOM     32  C   LIG    1        7.520  -1.327   1.212  0.00  0.00    +0.010 C 
ENDBRANCH  19  32
ENDBRANCH  18  28
ENDBRANCH   1  18
TORSDOF 4