REMARK  Name = BDB053797
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.487  -0.525   0.278  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        0.173  -0.997   0.336  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1       -0.898  -0.180  -0.041  0.00  0.00    -0.009 A 
ATOM      4  C   LIG    1       -0.650   1.124  -0.487  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1        0.663   1.605  -0.548  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1        1.728   0.775  -0.163  0.00  0.00    +0.057 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -2.251  -0.690   0.016  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -3.273  -0.140   0.760  0.00  0.00    +0.142 A 
ATOM      9  C   LIG    1       -3.395   1.015   1.670  0.00  0.00    +0.090 C 
ATOM     10  O   LIG    1       -4.401  -0.879   0.582  0.00  0.00    -0.359 OA
ATOM     11  N   LIG    1       -4.138  -1.935  -0.268  0.00  0.00    -0.083 NA
ATOM     12  C   LIG    1       -2.846  -1.822  -0.602  0.00  0.00    +0.088 A 
ATOM     13  C   LIG    1       -2.228  -2.810  -1.517  0.00  0.00    +0.070 C 
ENDBRANCH   3   7
BRANCH   5  14
ATOM     14  C   LIG    1        0.980   2.988  -1.018  0.00  0.00    +0.160 C 
ATOM     15  O   LIG    1        2.148   3.370  -1.044  0.00  0.00    -0.292 OA
ATOM     16  C   LIG    1       -0.146   3.891  -1.450  0.00  0.00    +0.091 C 
ENDBRANCH   5  14
BRANCH   1  17
ATOM     17  O   LIG    1        2.433  -1.428   0.677  0.00  0.00    -0.492 OA
BRANCH  17  19
ATOM     18  C   LIG    1        4.655  -2.155   1.136  0.00  0.00    +0.048 C 
ATOM     19  C   LIG    1        3.795  -1.002   0.651  0.00  0.00    +0.225 C 
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 4