REMARK  Name = BDB003808
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.574  -0.227   1.758  0.00  0.00    -0.273 OA
ATOM      2  C   LIG    1       -4.402  -0.060   1.418  0.00  0.00    +0.245 C 
ATOM      3  N   LIG    1       -3.779  -1.021   0.668  0.00  0.00    -0.254 N 
ATOM      4  H   LIG    1       -4.509  -1.709   0.508  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -3.264  -0.692  -0.557  0.00  0.00    +0.229 C 
ATOM      6  O   LIG    1       -3.881  -1.026  -1.569  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -1.907   0.018  -0.610  0.00  0.00    +0.086 C 
ATOM      8  C   LIG    1       -0.874  -0.882   0.097  0.00  0.00    +0.126 C 
ATOM      9  N   LIG    1        0.512  -0.456  -0.121  0.00  0.00    -0.296 N 
ATOM     10  C   LIG    1        1.444  -0.890   0.835  0.00  0.00    +0.247 C 
ATOM     11  O   LIG    1        1.159  -1.641   1.765  0.00  0.00    -0.270 OA
ATOM     12  C   LIG    1        0.905  -0.296  -1.522  0.00  0.00    +0.108 C 
ATOM     13  C   LIG    1       -0.041   0.635  -2.266  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -1.495   0.196  -2.096  0.00  0.00    +0.021 C 
ATOM     15  C   LIG    1       -2.027   1.393   0.061  0.00  0.00    +0.178 C 
ATOM     16  O   LIG    1       -2.268   1.290   1.460  0.00  0.00    -0.369 OA
ATOM     17  C   LIG    1       -3.638   1.208   1.788  0.00  0.00    +0.255 C 
ENDROOT
BRANCH  10  18
ATOM     18  C   LIG    1        2.838  -0.396   0.744  0.00  0.00    +0.037 A 
ATOM     19  C   LIG    1        3.102   0.969   0.575  0.00  0.00    +0.013 A 
ATOM     20  C   LIG    1        4.423   1.417   0.518  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        5.474   0.507   0.645  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        5.210  -0.850   0.839  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        3.891  -1.303   0.897  0.00  0.00    +0.013 A 
ENDBRANCH  10  18
TORSDOF 1