REMARK  Name = BDB001509
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.692  -1.905  -2.058  0.00  0.00    -0.297 N 
ATOM      2  H   LIG    1       -0.589  -2.105  -3.049  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.069  -1.835  -1.721  0.00  0.00    +0.164 A 
ATOM      4  C   LIG    1       -2.931  -2.735  -2.323  0.00  0.00    +0.181 A 
ATOM      5  F   LIG    1       -2.505  -3.623  -3.232  0.00  0.00    -0.200 F 
ATOM      6  C   LIG    1       -4.249  -2.668  -1.961  0.00  0.00    +0.156 A 
ATOM      7  N   LIG    1       -4.721  -1.781  -1.065  0.00  0.00    -0.220 NA
ATOM      8  C   LIG    1       -3.836  -0.937  -0.514  0.00  0.00    +0.221 A 
ATOM      9  N   LIG    1       -2.525  -0.945  -0.815  0.00  0.00    -0.196 NA
BRANCH   8  10
ATOM     10  N   LIG    1       -4.212   0.024   0.419  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -3.397   0.560   0.680  0.00  0.00    +0.155 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -5.426   0.391   1.009  0.00  0.00    +0.034 A 
ATOM     13  C   LIG    1       -6.645  -0.243   0.749  0.00  0.00    +0.027 A 
ATOM     14  C   LIG    1       -7.826   0.172   1.375  0.00  0.00    +0.047 A 
ATOM     15  C   LIG    1       -7.798   1.229   2.272  0.00  0.00    +0.117 A 
ATOM     16  C   LIG    1       -6.605   1.880   2.554  0.00  0.00    +0.047 A 
ATOM     17  C   LIG    1       -5.429   1.459   1.924  0.00  0.00    +0.027 A 
BRANCH  15  18
ATOM     18  O   LIG    1       -8.970   1.601   2.858  0.00  0.00    -0.507 OA
ATOM     19  H   LIG    1       -8.795   2.346   3.456  0.00  0.00    +0.292 HD
ENDBRANCH  15  18
ENDBRANCH  10  12
ENDBRANCH   8  10
ENDBRANCH   1   3
BRANCH   1  23
ATOM     20  C   LIG    1        2.705   0.062  -0.469  0.00  0.00    +0.037 A 
ATOM     21  C   LIG    1        1.556  -0.075   0.313  0.00  0.00    +0.015 A 
ATOM     22  C   LIG    1        0.425  -0.720  -0.202  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1        0.406  -1.212  -1.512  0.00  0.00    +0.032 A 
ATOM     24  C   LIG    1        1.573  -1.076  -2.283  0.00  0.00    +0.024 A 
ATOM     25  C   LIG    1        2.709  -0.434  -1.776  0.00  0.00    +0.015 A 
BRANCH  20  27
ATOM     26  O   LIG    1        3.693   1.690   0.880  0.00  0.00    -0.270 OA
ATOM     27  C   LIG    1        3.888   0.754   0.115  0.00  0.00    +0.248 C 
ATOM     28  N   LIG    1        5.111   0.223  -0.254  0.00  0.00    -0.281 N 
ATOM     29  H   LIG    1        5.093  -0.639  -0.783  0.00  0.00    +0.155 HD
BRANCH  28  30
ATOM     30  C   LIG    1        6.391   0.693   0.107  0.00  0.00    +0.036 A 
ATOM     31  C   LIG    1        7.492  -0.061  -0.315  0.00  0.00    +0.061 A 
ATOM     32  C   LIG    1        8.783   0.352   0.004  0.00  0.00    +0.125 A 
ATOM     33  F   LIG    1        9.826  -0.382  -0.407  0.00  0.00    -0.205 F 
ATOM     34  C   LIG    1        9.008   1.509   0.737  0.00  0.00    +0.038 A 
ATOM     35  C   LIG    1        7.920   2.267   1.158  0.00  0.00    +0.005 A 
ATOM     36  C   LIG    1        6.617   1.861   0.843  0.00  0.00    +0.023 A 
ENDBRANCH  28  30
ENDBRANCH  20  27
ENDBRANCH   1  23
TORSDOF 7