REMARK  Name = BDB064128
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.233  -1.038   1.525  0.00  0.00    -0.023 A 
ATOM      2  C   LIG    1       -0.876  -1.387   1.339  0.00  0.00    -0.013 A 
ATOM      3  C   LIG    1       -0.434  -2.649   1.780  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1       -1.311  -3.554   2.380  0.00  0.00    +0.001 A 
ATOM      5  C   LIG    1       -2.649  -3.216   2.543  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -3.108  -1.971   2.115  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1        0.089  -0.490   0.690  0.00  0.00    -0.018 A 
ATOM      8  C   LIG    1        0.722   0.531   1.411  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        1.642   1.380   0.790  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        1.953   1.224  -0.568  0.00  0.00    -0.028 A 
ATOM     11  C   LIG    1        1.329   0.197  -1.290  0.00  0.00    +0.006 A 
ATOM     12  C   LIG    1        0.410  -0.650  -0.666  0.00  0.00    +0.009 A 
BRANCH  10  13
ATOM     13  C   LIG    1        2.957   2.131  -1.234  0.00  0.00    +0.157 C 
BRANCH  13  14
ATOM     14  N   LIG    1        4.318   1.798  -0.853  0.00  0.00    -0.332 N 
ATOM     15  C   LIG    1        5.049   0.747  -1.332  0.00  0.00    +0.199 A 
ATOM     16  N   LIG    1        6.266   0.745  -0.837  0.00  0.00    -0.244 NA
ATOM     17  C   LIG    1        6.321   1.834  -0.006  0.00  0.00    +0.130 A 
ATOM     18  C   LIG    1        5.122   2.509  -0.006  0.00  0.00    +0.107 A 
ENDBRANCH  13  14
ENDBRANCH  10  13
ENDBRANCH   2   7
BRANCH   1  19
ATOM     19  C   LIG    1       -2.803   0.286   1.069  0.00  0.00    +0.140 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -4.375  -0.041  -0.789  0.00  0.00    +0.237 C 
ATOM     21  N   LIG    1       -3.119   0.263  -0.339  0.00  0.00    -0.308 N 
ATOM     22  H   LIG    1       -2.341   0.215  -0.978  0.00  0.00    +0.149 HD
ATOM     23  O   LIG    1       -5.349  -0.228  -0.070  0.00  0.00    -0.271 OA
BRANCH  20  25
ATOM     24  C   LIG    1       -3.726   0.392  -3.178  0.00  0.00    +0.013 C 
ATOM     25  C   LIG    1       -4.503  -0.199  -2.261  0.00  0.00    +0.059 C 
ENDBRANCH  20  25
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 6