REMARK  Name = BDB007576
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.914   0.878  -0.775  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -1.085  -0.264  -1.187  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1       -0.218  -0.881  -2.063  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1       -0.494  -1.744  -2.513  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.281  -1.046  -0.767  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1       -3.427  -0.343  -0.369  0.00  0.00    +0.017 A 
ATOM      7  C   LIG    1       -4.585  -1.021   0.042  0.00  0.00    -0.043 A 
ATOM      8  C   LIG    1       -4.570  -2.424   0.053  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1       -3.426  -3.130  -0.327  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -2.281  -2.445  -0.733  0.00  0.00    +0.013 A 
BRANCH   7  11
ATOM     11  C   LIG    1       -5.837  -0.276   0.470  0.00  0.00    +0.023 C 
ATOM     12  C   LIG    1       -5.597   0.620   1.694  0.00  0.00    +0.036 C 
ATOM     13  C   LIG    1       -6.869   1.379   2.048  0.00  0.00    +0.160 C 
ATOM     14  O   LIG    1       -7.334   2.136   0.931  0.00  0.00    -0.380 OA
ATOM     15  C   LIG    1       -7.666   1.311  -0.185  0.00  0.00    +0.160 C 
ATOM     16  C   LIG    1       -6.442   0.548  -0.676  0.00  0.00    +0.036 C 
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  17
ATOM     17  C   LIG    1        0.932  -0.182  -2.622  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.233  -0.428  -1.835  0.00  0.00    +0.145 C 
BRANCH  18  19
ATOM     19  O   LIG    1        2.411  -1.849  -1.708  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1        1.704  -2.148  -1.109  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        2.232   0.265  -0.447  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.510   0.344   0.291  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        4.451   1.299  -0.316  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        5.782   1.376   0.407  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        6.202   0.338   1.258  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        7.450   0.419   1.891  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        8.287   1.510   1.661  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.882   2.530   0.804  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.282  -0.823   1.538  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        6.637   2.464   0.177  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        4.162  -0.952   0.495  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7