REMARK  Name = BDB031606
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.927   0.051   0.237  0.00  0.00    -0.303 N 
ATOM      2  H   LIG    1       -0.312   0.710  -0.233  0.00  0.00    +0.149 HD
ATOM      3  C   LIG    1       -0.299  -1.076   0.729  0.00  0.00    +0.221 C 
ATOM      4  O   LIG    1       -0.750  -1.684   1.700  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        0.920  -1.589  -0.064  0.00  0.00    +0.108 C 
ATOM      6  C   LIG    1        1.792  -0.494  -0.650  0.00  0.00    -0.015 A 
ATOM      7  C   LIG    1        2.909  -0.031   0.068  0.00  0.00    +0.031 A 
ATOM      8  C   LIG    1        3.684   0.994  -0.487  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        3.346   1.574  -1.712  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        2.242   1.111  -2.419  0.00  0.00    +0.000 A 
ATOM     11  N   LIG    1        3.364  -0.675   1.220  0.00  0.00    -0.344 N 
ATOM     12  H   LIG    1        3.861  -0.061   1.859  0.00  0.00    +0.146 HD
ATOM     13  C   LIG    1        2.496  -1.647   1.868  0.00  0.00    +0.102 C 
ATOM     14  C   LIG    1        1.472   0.074  -1.897  0.00  0.00    +0.006 A 
ATOM     15  C   LIG    1        1.777  -2.498   0.827  0.00  0.00    +0.036 C 
ENDBRANCH   3   5
BRANCH   1  22
ATOM     16  O   LIG    1       -4.827   1.543  -1.954  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -4.111   1.278  -0.993  0.00  0.00    +0.219 C 
ATOM     18  N   LIG    1       -3.390   2.259  -0.362  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1       -3.465   3.172  -0.790  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1       -2.258   2.061   0.386  0.00  0.00    +0.240 C 
ATOM     21  O   LIG    1       -1.400   2.941   0.458  0.00  0.00    -0.273 OA
ATOM     22  C   LIG    1       -2.039   0.659   0.965  0.00  0.00    +0.160 C 
ATOM     23  C   LIG    1       -3.332  -0.155   0.901  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -3.906  -0.136  -0.506  0.00  0.00    +0.098 C 
ENDBRANCH   1  22
TORSDOF 2