REMARK  Name = BDB014828
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.609   0.366  -0.497  0.00  0.00    -0.018 A 
ATOM      2  C   LIG    1        1.808   1.392   0.024  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1        0.414   1.262   0.098  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1       -0.232   0.104  -0.340  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1        0.570  -0.922  -0.864  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1        1.963  -0.795  -0.940  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        6.319  -0.373  -0.160  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        4.924  -0.502  -0.087  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        4.074   0.504  -0.577  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        4.665   1.643  -1.149  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        6.054   1.772  -1.239  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        6.883   0.764  -0.748  0.00  0.00    +0.013 A 
BRANCH   7  16
ATOM     13  C   LIG    1        9.237  -2.097   1.514  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        8.401  -1.121   0.860  0.00  0.00    -0.314 N 
ATOM     15  H   LIG    1        8.578  -0.145   1.055  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.159  -1.479   0.374  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        6.728  -2.626   0.396  0.00  0.00    -0.270 OA
ENDBRANCH   7  16
ENDBRANCH   1   9
BRANCH   4  18
ATOM     18  N   LIG    1       -1.632  -0.084  -0.300  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1       -1.879  -1.013  -0.612  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.641   0.734   0.094  0.00  0.00    +0.150 A 
ATOM     21  C   LIG    1       -4.000   0.313   0.083  0.00  0.00    +0.032 A 
ATOM     22  C   LIG    1       -4.625  -0.976  -0.312  0.00  0.00    +0.148 C 
ATOM     23  N   LIG    1       -6.073  -0.974  -0.013  0.00  0.00    -0.297 N 
ATOM     24  C   LIG    1       -6.799   0.305  -0.166  0.00  0.00    +0.114 C 
ATOM     25  C   LIG    1       -6.190   1.446   0.675  0.00  0.00    +0.074 C 
ATOM     26  C   LIG    1       -6.825  -2.143   0.010  0.00  0.00    +0.213 C 
ATOM     27  O   LIG    1       -8.056  -2.146   0.031  0.00  0.00    -0.276 OA
ATOM     28  C   LIG    1       -6.069  -3.448   0.026  0.00  0.00    +0.109 C 
ATOM     29  C   LIG    1       -4.717   1.404   0.524  0.00  0.00    +0.047 A 
ATOM     30  N   LIG    1       -3.810   2.376   0.796  0.00  0.00    -0.269 N 
ATOM     31  C   LIG    1       -4.050   3.703   1.306  0.00  0.00    +0.172 C 
ATOM     32  N   LIG    1       -2.550   1.998   0.523  0.00  0.00    -0.156 NA
ENDBRANCH  18  20
ENDBRANCH   4  18
TORSDOF 4