REMARK  Name = BDB059719
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.399  -0.654  -1.095  0.00  0.00    +0.143 A 
ATOM      2  C   LIG    1       -2.444  -1.703  -1.281  0.00  0.00    +0.265 A 
ATOM      3  O   LIG    1       -2.222  -2.792  -1.800  0.00  0.00    -0.267 OA
ATOM      4  N   LIG    1       -3.703  -1.423  -0.816  0.00  0.00    -0.320 N 
ATOM      5  H   LIG    1       -4.389  -2.154  -0.961  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -4.025  -0.269  -0.099  0.00  0.00    +0.071 A 
ATOM      7  C   LIG    1       -3.045   0.696   0.141  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1       -3.385   1.799   0.930  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1       -4.685   1.904   1.405  0.00  0.00    +0.111 A 
ATOM     10  N   LIG    1       -5.652   0.997   1.155  0.00  0.00    -0.261 NA
ATOM     11  C   LIG    1       -5.301  -0.076   0.414  0.00  0.00    +0.137 A 
ATOM     12  C   LIG    1       -1.703   0.484  -0.436  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1  14
ATOM     13  O   LIG    1        0.062  -1.226  -2.880  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1       -0.061  -0.839  -1.723  0.00  0.00    +0.253 C 
ATOM     15  N   LIG    1        1.010  -0.532  -0.917  0.00  0.00    -0.307 N 
ATOM     16  H   LIG    1        0.832   0.006  -0.076  0.00  0.00    +0.149 HD
BRANCH  15  17
ATOM     17  C   LIG    1        2.352  -0.540  -1.443  0.00  0.00    +0.139 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.356  -0.318  -0.345  0.00  0.00    -0.030 A 
ATOM     19  C   LIG    1        3.883   0.959  -0.105  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1        4.795   1.164   0.931  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.183   0.099   1.742  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        4.658  -1.173   1.519  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        3.746  -1.380   0.483  0.00  0.00    +0.005 A 
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH   1  14
BRANCH  12  24
ATOM     24  O   LIG    1       -0.791   1.516  -0.295  0.00  0.00    -0.505 OA
ATOM     25  H   LIG    1       -1.258   2.357  -0.449  0.00  0.00    +0.292 HD
ENDBRANCH  12  24
TORSDOF 4