REMARK  Name = BDB015724
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.423   2.692  -0.316  0.00  0.00    +0.126 A 
ATOM      2  N   LIG    1        1.473   2.194  -0.979  0.00  0.00    -0.180 NA
ATOM      3  C   LIG    1        1.521   0.864  -1.135  0.00  0.00    +0.326 A 
ATOM      4  N   LIG    1        0.582  -0.004  -0.729  0.00  0.00    -0.194 NA
ATOM      5  C   LIG    1       -0.479   0.522  -0.094  0.00  0.00    +0.081 A 
ATOM      6  C   LIG    1       -0.593   1.878   0.147  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1       -1.494  -0.456   0.368  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1       -2.807  -0.183   0.243  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -3.789  -1.072   0.651  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -5.182  -0.689   0.477  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -3.492  -2.317   1.206  0.00  0.00    +0.254 A 
ATOM     12  O   LIG    1       -4.338  -3.123   1.586  0.00  0.00    -0.267 OA
ATOM     13  C   LIG    1       -2.036  -2.648   1.323  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -1.690  -3.988   1.888  0.00  0.00    +0.049 C 
ATOM     15  C   LIG    1       -1.123  -1.751   0.916  0.00  0.00    +0.020 A 
ENDBRANCH   5   7
BRANCH   1  16
ATOM     16  N   LIG    1        0.295   4.080  -0.112  0.00  0.00    -0.329 N 
ATOM     17  H   LIG    1        0.113   4.259   0.872  0.00  0.00    +0.147 HD
BRANCH  16  19
ATOM     18  C   LIG    1        1.145   6.346  -0.355  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1        1.423   4.871  -0.603  0.00  0.00    +0.099 C 
ENDBRANCH  16  19
ENDBRANCH   1  16
BRANCH   3  20
ATOM     20  O   LIG    1        2.625   0.397  -1.839  0.00  0.00    -0.421 OA
BRANCH  20  21
ATOM     21  C   LIG    1        2.912  -0.937  -1.696  0.00  0.00    +0.167 A 
ATOM     22  C   LIG    1        3.300  -1.480  -0.467  0.00  0.00    +0.168 A 
ATOM     23  F   LIG    1        3.382  -0.703   0.623  0.00  0.00    -0.202 F 
ATOM     24  C   LIG    1        3.618  -2.828  -0.356  0.00  0.00    +0.080 A 
ATOM     25  C   LIG    1        3.557  -3.626  -1.491  0.00  0.00    +0.126 A 
ATOM     26  F   LIG    1        3.861  -4.927  -1.397  0.00  0.00    -0.205 F 
ATOM     27  C   LIG    1        3.193  -3.098  -2.729  0.00  0.00    +0.042 A 
ATOM     28  C   LIG    1        2.877  -1.743  -2.836  0.00  0.00    +0.052 A 
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 5