REMARK  Name = BDB001537
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.611   0.076   3.401  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1       -2.114  -0.105   4.677  0.00  0.00    +0.181 A 
ATOM      3  F   LIG    1       -1.355   0.059   5.769  0.00  0.00    -0.200 F 
ATOM      4  C   LIG    1       -3.436  -0.449   4.779  0.00  0.00    +0.156 A 
ATOM      5  N   LIG    1       -4.240  -0.611   3.711  0.00  0.00    -0.220 NA
ATOM      6  C   LIG    1       -3.691  -0.414   2.499  0.00  0.00    +0.221 A 
ATOM      7  N   LIG    1       -2.401  -0.085   2.320  0.00  0.00    -0.196 NA
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1       -0.234   0.394   3.268  0.00  0.00    -0.297 N 
ATOM      9  H   LIG    1        0.043   1.050   3.991  0.00  0.00    +0.154 HD
BRANCH   8  13
ATOM     10  C   LIG    1        2.280   0.627  -0.135  0.00  0.00    +0.037 A 
ATOM     11  C   LIG    1        1.125  -0.157  -0.179  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1        0.286  -0.241   0.939  0.00  0.00    +0.024 A 
ATOM     13  C   LIG    1        0.559   0.478   2.107  0.00  0.00    +0.032 A 
ATOM     14  C   LIG    1        1.730   1.254   2.140  0.00  0.00    +0.024 A 
ATOM     15  C   LIG    1        2.579   1.340   1.030  0.00  0.00    +0.015 A 
BRANCH  10  18
ATOM     16  N   LIG    1        4.496   0.874  -1.114  0.00  0.00    -0.311 N 
ATOM     17  H   LIG    1        4.850   0.817  -0.170  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1        3.148   0.684  -1.342  0.00  0.00    +0.244 C 
ATOM     19  O   LIG    1        2.661   0.534  -2.457  0.00  0.00    -0.270 OA
BRANCH  16  20
ATOM     20  C   LIG    1        5.463   0.881  -2.194  0.00  0.00    +0.104 C 
BRANCH  20  22
ATOM     21  C   LIG    1        5.267  -1.573  -2.852  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1        6.176  -0.461  -2.350  0.00  0.00    +0.015 C 
ENDBRANCH  20  22
ENDBRANCH  16  20
ENDBRANCH  10  18
ENDBRANCH   8  13
ENDBRANCH   1   8
BRANCH   6  23
ATOM     23  N   LIG    1       -4.557  -0.605   1.428  0.00  0.00    -0.284 N 
ATOM     24  H   LIG    1       -5.463  -0.877   1.780  0.00  0.00    +0.155 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.461  -0.369   0.052  0.00  0.00    +0.034 A 
ATOM     26  C   LIG    1       -3.375   0.269  -0.556  0.00  0.00    +0.027 A 
ATOM     27  C   LIG    1       -3.318   0.439  -1.944  0.00  0.00    +0.047 A 
ATOM     28  C   LIG    1       -4.348  -0.038  -2.740  0.00  0.00    +0.117 A 
ATOM     29  C   LIG    1       -5.436  -0.685  -2.171  0.00  0.00    +0.047 A 
ATOM     30  C   LIG    1       -5.485  -0.851  -0.783  0.00  0.00    +0.027 A 
BRANCH  28  31
ATOM     31  O   LIG    1       -4.255   0.149  -4.087  0.00  0.00    -0.507 OA
ATOM     32  H   LIG    1       -5.029  -0.253  -4.511  0.00  0.00    +0.292 HD
ENDBRANCH  28  31
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 8