REMARK  Name = BDB001140
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.158  -0.305   0.182  0.00  0.00    +0.064 A 
ATOM      2  C   LIG    1       -1.997   0.472   0.356  0.00  0.00    +0.102 A 
ATOM      3  C   LIG    1       -2.164   1.820   0.766  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1       -1.119   2.643   0.955  0.00  0.00    -0.251 NA
ATOM      5  C   LIG    1        0.112   2.126   0.740  0.00  0.00    +0.139 A 
ATOM      6  C   LIG    1        0.322   0.817   0.340  0.00  0.00    +0.090 A 
ATOM      7  C   LIG    1       -3.435   2.333   0.989  0.00  0.00    +0.030 A 
ATOM      8  C   LIG    1       -4.574   1.554   0.821  0.00  0.00    +0.003 A 
ATOM      9  N   LIG    1       -0.738  -0.011   0.152  0.00  0.00    -0.243 NA
ATOM     10  C   LIG    1       -4.435   0.235   0.418  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1        1.655   0.238   0.109  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        1.924  -1.102   0.437  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1        3.188  -1.665   0.225  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        4.234  -0.899  -0.287  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1        3.963   0.412  -0.679  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        2.700   0.980  -0.467  0.00  0.00    +0.012 A 
BRANCH  14  17
ATOM     17  N   LIG    1        5.456  -1.495  -0.609  0.00  0.00    -0.358 N 
ATOM     18  H   LIG    1        5.682  -2.307  -0.043  0.00  0.00    +0.142 HD
ATOM     19  H   LIG    1        6.232  -0.843  -0.674  0.00  0.00    +0.142 HD
ENDBRANCH  14  17
ENDBRANCH   6  11
BRANCH   1  23
ATOM     20  N   LIG    1       -1.921  -2.262  -0.635  0.00  0.00    -0.325 N 
ATOM     21  H   LIG    1       -1.065  -1.715  -0.579  0.00  0.00    +0.145 HD
ATOM     22  H   LIG    1       -1.880  -3.227  -0.927  0.00  0.00    +0.145 HD
ATOM     23  C   LIG    1       -3.119  -1.731  -0.261  0.00  0.00    +0.244 C 
ATOM     24  O   LIG    1       -4.137  -2.415  -0.301  0.00  0.00    -0.270 OA
ENDBRANCH   1  23
TORSDOF 3