REMARK  Name = BDB001775
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.417  -0.710   0.018  0.00  0.00    +0.184 A 
ATOM      2  N   LIG    1        0.462   0.179  -0.277  0.00  0.00    -0.141 NA
ATOM      3  N   LIG    1       -0.684  -0.559  -0.216  0.00  0.00    -0.166 N 
ATOM      4  C   LIG    1       -1.928   0.088  -0.343  0.00  0.00    +0.255 C 
ATOM      5  O   LIG    1       -1.966   1.273  -0.661  0.00  0.00    -0.270 OA
ATOM      6  C   LIG    1       -0.338  -1.892   0.003  0.00  0.00    +0.219 A 
ATOM      7  N   LIG    1        0.951  -1.988   0.201  0.00  0.00    -0.193 NA
ENDROOT
BRANCH   1  11
ATOM      8  C   LIG    1        5.575   0.266   0.334  0.00  0.00    +0.120 A 
ATOM      9  C   LIG    1        5.133  -1.042   0.540  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        3.776  -1.363   0.438  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1        2.834  -0.375   0.125  0.00  0.00    +0.021 A 
ATOM     12  C   LIG    1        3.284   0.937  -0.081  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1        4.644   1.257   0.022  0.00  0.00    +0.046 A 
BRANCH   8  15
ATOM     14  C   LIG    1        7.423   1.759   0.267  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1        6.925   0.442   0.464  0.00  0.00    -0.495 OA
ENDBRANCH   8  15
ENDBRANCH   1  11
BRANCH   6  16
ATOM     16  N   LIG    1       -1.179  -2.954   0.004  0.00  0.00    -0.327 N 
ATOM     17  H   LIG    1       -0.676  -3.820   0.210  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1       -1.698  -3.116  -0.858  0.00  0.00    +0.145 HD
ENDBRANCH   6  16
BRANCH   4  19
ATOM     19  C   LIG    1       -3.131  -0.780  -0.066  0.00  0.00    +0.136 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -4.434  -0.014   0.018  0.00  0.00    -0.038 A 
ATOM     21  C   LIG    1       -4.935   0.403   1.259  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -6.134   1.114   1.334  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -6.839   1.420   0.172  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.344   1.020  -1.068  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -5.146   0.308  -1.146  0.00  0.00    +0.004 A 
ENDBRANCH  19  20
ENDBRANCH   4  19
TORSDOF 5