REMARK  Name = BDB003142
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.840  -1.108   0.193  0.00  0.00    -0.423 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.148  -0.651  -0.005  0.00  0.00    +0.169 A 
ATOM      3  C   LIG    1       -3.205  -1.448  -0.230  0.00  0.00    +0.232 A 
ATOM      4  C   LIG    1       -4.548  -0.891  -0.466  0.00  0.00    +0.283 A 
ATOM      5  O   LIG    1       -5.559  -1.565  -0.616  0.00  0.00    -0.265 OA
ATOM      6  N   LIG    1       -4.604   0.492  -0.488  0.00  0.00    -0.324 N 
ATOM      7  H   LIG    1       -5.526   0.887  -0.648  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1       -3.522   1.325  -0.289  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1       -3.780   2.800  -0.344  0.00  0.00    +0.063 C 
ATOM     10  C   LIG    1       -2.312   0.791  -0.054  0.00  0.00    +0.069 A 
BRANCH   3  11
ATOM     11  N   LIG    1       -3.014  -2.860  -0.289  0.00  0.00    +0.065 N 
ATOM     12  O   LIG    1       -3.267  -3.421  -1.362  0.00  0.00    -0.126 OA
ATOM     13  O   LIG    1       -2.550  -3.419   0.717  0.00  0.00    -0.126 OA
ENDBRANCH   3  11
ENDBRANCH   1   2
BRANCH   1  14
ATOM     14  C   LIG    1       -0.488  -1.144   1.525  0.00  0.00    +0.317 C 
ATOM     15  O   LIG    1       -1.186  -0.772   2.461  0.00  0.00    -0.250 OA
BRANCH  14  16
ATOM     16  C   LIG    1        0.900  -1.719   1.680  0.00  0.00    +0.156 C 
BRANCH  16  20
ATOM     17  C   LIG    1        3.902   0.778  -0.177  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1        3.325   1.146   1.040  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        2.361   0.337   1.647  0.00  0.00    +0.008 A 
ATOM     20  C   LIG    1        1.961  -0.859   1.040  0.00  0.00    -0.037 A 
ATOM     21  C   LIG    1        2.539  -1.225  -0.182  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        3.504  -0.412  -0.786  0.00  0.00    +0.046 A 
BRANCH  17  24
ATOM     23  C   LIG    1        5.477   1.310  -1.876  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        4.828   1.660  -0.660  0.00  0.00    -0.495 OA
ENDBRANCH  17  24
ENDBRANCH  16  20
ENDBRANCH  14  16
ENDBRANCH   1  14
TORSDOF 6