REMARK  Name = BDB059644
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.594   0.519   0.027  0.00  0.00    +0.060 A 
ATOM      2  C   LIG    1       -1.522  -0.455  -0.176  0.00  0.00    +0.045 A 
ATOM      3  C   LIG    1       -2.987  -0.064  -0.105  0.00  0.00    +0.279 A 
ATOM      4  O   LIG    1       -3.917  -0.837  -0.300  0.00  0.00    -0.265 OA
ATOM      5  N   LIG    1       -3.230   1.284   0.202  0.00  0.00    -0.179 N 
ATOM      6  C   LIG    1       -2.248   2.226   0.416  0.00  0.00    +0.156 A 
ATOM      7  C   LIG    1       -2.888   3.409   0.686  0.00  0.00    +0.114 A 
ATOM      8  C   LIG    1       -4.258   3.099   0.612  0.00  0.00    +0.156 A 
ATOM      9  N   LIG    1       -4.480   1.814   0.319  0.00  0.00    -0.169 NA
ATOM     10  N   LIG    1       -0.961   1.830   0.323  0.00  0.00    -0.338 N 
ATOM     11  H   LIG    1       -0.180   2.477   0.449  0.00  0.00    +0.167 HD
ENDROOT
BRANCH   1  15
ATOM     12  N   LIG    1        2.931   0.083   0.455  0.00  0.00    -0.271 N 
ATOM     13  N   LIG    1        2.913  -0.006  -0.889  0.00  0.00    -0.179 NA
ATOM     14  C   LIG    1        1.621   0.134  -1.200  0.00  0.00    +0.144 A 
ATOM     15  C   LIG    1        0.816   0.300  -0.057  0.00  0.00    +0.036 A 
ATOM     16  C   LIG    1        1.696   0.297   1.001  0.00  0.00    +0.118 A 
BRANCH  12  18
ATOM     17  C   LIG    1        4.564  -1.484   1.425  0.00  0.00    +0.029 C 
ATOM     18  C   LIG    1        4.188  -0.035   1.169  0.00  0.00    +0.140 C 
ENDBRANCH  12  18
ENDBRANCH   1  15
BRANCH   2  19
ATOM     19  C   LIG    1       -1.318  -1.945  -0.452  0.00  0.00    +0.020 C 
ATOM     20  C   LIG    1       -0.171  -2.630   0.299  0.00  0.00    +0.012 C 
ATOM     21  C   LIG    1       -1.223  -2.218  -1.954  0.00  0.00    +0.012 C 
ENDBRANCH   2  19
BRANCH   7  22
ATOM     22  C   LIG    1       -2.292   4.667   0.975  0.00  0.00    +0.104 C 
ATOM     23  N   LIG    1       -1.793   5.686   1.213  0.00  0.00    -0.191 NA
ENDBRANCH   7  22
TORSDOF 4