REMARK  Name = BDB011607
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.655  -0.385   0.339  0.00  0.00    +0.270 C 
ATOM      2  N   LIG    1       -0.164   0.726   0.325  0.00  0.00    -0.274 N 
ATOM      3  H   LIG    1        0.319   1.609   0.445  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.296  -1.549   0.450  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.530   0.752   0.260  0.00  0.00    +0.122 A 
ATOM      6  C   LIG    1       -2.448  -0.334  -0.226  0.00  0.00    +0.293 A 
ATOM      7  O   LIG    1       -2.086  -1.369  -0.764  0.00  0.00    -0.264 OA
ATOM      8  N   LIG    1       -3.758   0.163  -0.078  0.00  0.00    -0.213 N 
ATOM      9  N   LIG    1       -3.692   1.492   0.419  0.00  0.00    -0.282 N 
ATOM     10  C   LIG    1       -4.589   1.752   1.558  0.00  0.00    +0.171 C 
ATOM     11  C   LIG    1       -2.330   1.791   0.560  0.00  0.00    +0.059 A 
ATOM     12  C   LIG    1       -1.913   3.142   1.052  0.00  0.00    +0.067 C 
BRANCH   8  13
ATOM     13  C   LIG    1       -4.881  -0.303  -0.821  0.00  0.00    +0.102 A 
ATOM     14  C   LIG    1       -5.929   0.536  -1.234  0.00  0.00    +0.149 A 
ATOM     15  F   LIG    1       -5.916   1.855  -0.982  0.00  0.00    -0.203 F 
ATOM     16  C   LIG    1       -7.022   0.046  -1.954  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1       -7.094  -1.304  -2.281  0.00  0.00    +0.003 A 
ATOM     18  C   LIG    1       -6.070  -2.158  -1.886  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1       -4.977  -1.662  -1.164  0.00  0.00    +0.031 A 
ENDBRANCH   8  13
ENDBRANCH   2   5
BRANCH   1  25
ATOM     20  C   LIG    1        3.230  -2.328   0.037  0.00  0.00    +0.068 C 
ATOM     21  C   LIG    1        3.176  -0.857   0.229  0.00  0.00    +0.074 A 
ATOM     22  N   LIG    1        4.258   0.008   0.269  0.00  0.00    -0.215 N 
ATOM     23  N   LIG    1        3.811   1.288   0.161  0.00  0.00    -0.060 NA
ATOM     24  N   LIG    1        2.493   1.284   0.258  0.00  0.00    -0.124 NA
ATOM     25  C   LIG    1        2.071  -0.020   0.294  0.00  0.00    +0.170 A 
BRANCH  22  26
ATOM     26  C   LIG    1        5.651  -0.241   0.307  0.00  0.00    +0.086 A 
ATOM     27  C   LIG    1        6.241  -1.206   1.135  0.00  0.00    +0.068 A 
ATOM     28 CL   LIG    1        5.396  -2.047   2.388  0.00  0.00    -0.081 Cl
ATOM     29  C   LIG    1        7.625  -1.419   1.081  0.00  0.00    +0.042 A 
ATOM     30  C   LIG    1        8.419  -0.654   0.229  0.00  0.00    +0.042 A 
ATOM     31 CL   LIG    1       10.117  -0.922   0.175  0.00  0.00    -0.083 Cl
ATOM     32  C   LIG    1        7.851   0.342  -0.558  0.00  0.00    +0.022 A 
ATOM     33  C   LIG    1        6.473   0.558  -0.512  0.00  0.00    +0.031 A 
ENDBRANCH  22  26
ENDBRANCH   1  25
TORSDOF 4