REMARK  Name = BDB051006
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.084  -0.550   0.790  0.00  0.00    +0.213 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        1.463  -0.185   0.561  0.00  0.00    -0.215 N 
ATOM      3  C   LIG    1        2.365  -0.960  -0.116  0.00  0.00    +0.251 C 
ATOM      4  O   LIG    1        2.166  -2.098  -0.521  0.00  0.00    -0.272 OA
ATOM      5  C   LIG    1        3.653  -0.146  -0.268  0.00  0.00    +0.138 C 
ATOM      6  C   LIG    1        4.899  -0.766   0.291  0.00  0.00    -0.012 A 
ATOM      7  C   LIG    1        5.980  -0.542  -0.573  0.00  0.00    -0.042 A 
ATOM      8  C   LIG    1        7.254  -0.986  -0.260  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1        7.438  -1.677   0.940  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        6.359  -1.902   1.808  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        5.557   0.249  -1.773  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1        5.080  -1.441   1.490  0.00  0.00    +0.006 A 
ATOM     13  C   LIG    1        4.030   0.080  -1.741  0.00  0.00    +0.045 C 
ATOM     14  N   LIG    1        3.294   1.064   0.419  0.00  0.00    -0.281 N 
ATOM     15  H   LIG    1        3.899   1.855   0.588  0.00  0.00    +0.152 HD
ATOM     16  C   LIG    1        1.999   1.025   0.877  0.00  0.00    +0.310 C 
ATOM     17  O   LIG    1        1.458   1.937   1.481  0.00  0.00    -0.252 OA
ENDBRANCH   1   2
BRANCH   1  19
ATOM     18  N   LIG    1       -2.134  -0.402  -0.376  0.00  0.00    -0.293 N 
ATOM     19  C   LIG    1       -0.761  -0.131  -0.421  0.00  0.00    +0.234 C 
ATOM     20  O   LIG    1       -0.240   0.436  -1.387  0.00  0.00    -0.274 OA
BRANCH  18  22
ATOM     21  C   LIG    1       -2.829  -2.712   0.206  0.00  0.00    +0.028 C 
ATOM     22  C   LIG    1       -2.756  -1.252   0.661  0.00  0.00    +0.076 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.111  -0.750   1.089  0.00  0.00    +0.009 C 
ATOM     24  C   LIG    1       -4.547  -0.863   2.531  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -4.230   0.485   1.948  0.00  0.00    +0.005 C 
ENDBRANCH  22  23
ENDBRANCH  18  22
BRANCH  18  26
ATOM     26  C   LIG    1       -2.929  -0.011  -1.550  0.00  0.00    +0.143 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -3.672   1.297  -1.380  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -5.050   1.366  -1.638  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -5.742   2.571  -1.498  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.064   3.724  -1.110  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -3.694   3.675  -0.868  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -3.000   2.471  -1.008  0.00  0.00    +0.005 A 
ENDBRANCH  26  27
ENDBRANCH  18  26
ENDBRANCH   1  19
TORSDOF 6