REMARK  Name = BDB056174
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.512   0.245   1.177  0.00  0.00    +0.062 C 
ATOM      2  C   LIG    1       -5.033   0.541   0.957  0.00  0.00    +0.256 C 
ATOM      3  C   LIG    1       -4.856   1.578  -0.166  0.00  0.00    +0.258 C 
ATOM      4  O   LIG    1       -5.676   2.450  -0.444  0.00  0.00    -0.271 OA
ATOM      5  N   LIG    1       -3.640   1.529  -0.795  0.00  0.00    -0.280 N 
ATOM      6  H   LIG    1       -3.443   2.252  -1.473  0.00  0.00    +0.155 HD
ATOM      7  C   LIG    1       -2.749   0.478  -0.575  0.00  0.00    +0.076 A 
ATOM      8  C   LIG    1       -3.131  -0.605   0.221  0.00  0.00    +0.143 A 
ATOM      9  C   LIG    1       -2.261  -1.676   0.400  0.00  0.00    +0.048 A 
ATOM     10  C   LIG    1       -1.002  -1.657  -0.202  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1       -0.609  -0.576  -1.007  0.00  0.00    -0.032 A 
ATOM     12  C   LIG    1       -1.496   0.496  -1.190  0.00  0.00    +0.032 A 
ATOM     13  O   LIG    1       -4.366  -0.710   0.804  0.00  0.00    -0.478 OA
ENDROOT
BRANCH  11  14
ATOM     14  C   LIG    1        0.758  -0.567  -1.652  0.00  0.00    +0.116 C 
BRANCH  14  15
ATOM     15  N   LIG    1        1.796  -0.346  -0.653  0.00  0.00    -0.308 NA
ATOM     16  H   LIG    1        1.628   0.539  -0.176  0.00  0.00    +0.123 HD
BRANCH  15  17
ATOM     17  C   LIG    1        3.122  -0.310  -1.267  0.00  0.00    +0.116 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.184  -0.003  -0.239  0.00  0.00    -0.034 A 
ATOM     19  C   LIG    1        4.900   1.202  -0.283  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1        5.882   1.479   0.670  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        6.157   0.556   1.678  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        5.449  -0.643   1.736  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.468  -0.921   0.783  0.00  0.00    +0.005 A 
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH  14  15
ENDBRANCH  11  14
TORSDOF 4