REMARK  Name = BDB014473
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.612  -1.566  -2.069  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -1.513  -1.431  -1.244  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1       -1.311  -0.894   0.013  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1       -2.138  -0.525   0.471  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -0.047  -0.268   0.405  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1        1.174  -1.211   0.358  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1        1.744  -1.262  -0.954  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1        0.999  -1.439  -1.572  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1        2.264  -0.816   1.387  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1        2.560   0.631   1.489  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1        3.321   1.143   0.331  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1        4.797   0.797   0.323  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1        5.471   0.468   1.513  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1        6.845   0.192   1.480  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        7.550   0.266   0.280  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        6.888   0.605  -0.898  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        4.705   0.342   2.804  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        5.519   0.872  -0.877  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        3.300   0.957   2.722  0.00  0.00    +0.089 C 
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   5   6
ENDBRANCH   3   5
BRANCH   2  20
ATOM     20  C   LIG    1       -2.965  -1.837  -1.529  0.00  0.00    +0.324 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -3.633  -1.017  -2.487  0.00  0.00    -0.482 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -3.864   0.243  -1.994  0.00  0.00    +0.130 A 
ATOM     23  C   LIG    1       -4.947   0.545  -1.150  0.00  0.00    +0.044 A 
ATOM     24  C   LIG    1       -5.066   1.859  -0.668  0.00  0.00    +0.014 A 
ATOM     25  C   LIG    1       -4.153   2.849  -1.044  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -3.109   2.541  -1.913  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -2.972   1.242  -2.398  0.00  0.00    +0.046 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -5.953  -0.446  -0.764  0.00  0.00    +0.096 A 
ATOM     29  N   LIG    1       -6.503  -0.446   0.463  0.00  0.00    -0.174 NA
ATOM     30  N   LIG    1       -7.376  -1.465   0.442  0.00  0.00    -0.284 N 
ATOM     31  H   LIG    1       -7.927  -1.643   1.276  0.00  0.00    +0.188 HD
ATOM     32  C   LIG    1       -7.397  -2.141  -0.739  0.00  0.00    +0.105 A 
ATOM     33  C   LIG    1       -6.495  -1.499  -1.551  0.00  0.00    +0.049 A 
ENDBRANCH  23  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9