REMARK  Name = BDB002019
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.415  -0.840   0.266  0.00  0.00    +0.312 C 
ATOM      2  O   LIG    1        0.080  -1.034  -0.894  0.00  0.00    -0.250 OA
ENDROOT
BRANCH   1   3
ATOM      3  O   LIG    1       -0.381  -1.063   1.352  0.00  0.00    -0.459 OA
BRANCH   3   4
ATOM      4  C   LIG    1       -1.720  -1.490   1.057  0.00  0.00    +0.272 C 
BRANCH   4   7
ATOM      5  C   LIG    1       -2.917   0.099  -1.549  0.00  0.00    +0.069 C 
ATOM      6  C   LIG    1       -3.179   0.344  -0.110  0.00  0.00    +0.087 A 
ATOM      7  C   LIG    1       -2.657  -0.341   1.022  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1       -3.220   0.326   2.091  0.00  0.00    +0.141 A 
ATOM      9  C   LIG    1       -3.135   0.185   3.556  0.00  0.00    +0.089 C 
ATOM     10  O   LIG    1       -4.022   1.321   1.634  0.00  0.00    -0.359 OA
ATOM     11  N   LIG    1       -3.997   1.339   0.255  0.00  0.00    -0.083 NA
ENDBRANCH   4   7
ENDBRANCH   3   4
ENDBRANCH   1   3
BRANCH   1  12
ATOM     12  C   LIG    1        1.761  -0.332   0.737  0.00  0.00    +0.155 C 
BRANCH  12  13
ATOM     13  C   LIG    1        2.689   0.075  -0.384  0.00  0.00    -0.037 A 
ATOM     14  C   LIG    1        2.619   1.366  -0.929  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        3.467   1.739  -1.974  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        4.383   0.823  -2.484  0.00  0.00    +0.041 A 
ATOM     17 CL   LIG    1        5.428   1.283  -3.772  0.00  0.00    -0.084 Cl
ATOM     18  C   LIG    1        4.459  -0.465  -1.958  0.00  0.00    +0.020 A 
ATOM     19  C   LIG    1        3.612  -0.840  -0.913  0.00  0.00    +0.005 A 
ENDBRANCH  12  13
ENDBRANCH   1  12
TORSDOF 5