REMARK  Name = BDB059707
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.303   0.291  -0.156  0.00  0.00    +0.128 A 
ATOM      2  N   LIG    1        0.105   1.603  -0.095  0.00  0.00    -0.340 N 
ATOM      3  H   LIG    1       -0.523   2.395  -0.085  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1        1.473   1.633  -0.026  0.00  0.00    +0.067 A 
ATOM      5  C   LIG    1        1.857   0.294  -0.053  0.00  0.00    +0.104 A 
ATOM      6  C   LIG    1        3.228  -0.037   0.003  0.00  0.00    +0.099 A 
ATOM      7  C   LIG    1        4.144   1.022   0.084  0.00  0.00    +0.138 A 
ATOM      8  C   LIG    1        3.729   2.355   0.110  0.00  0.00    +0.041 A 
ATOM      9  F   LIG    1        5.465   0.794   0.142  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1        2.375   2.694   0.055  0.00  0.00    +0.030 A 
ATOM     11  N   LIG    1        0.737  -0.519  -0.135  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -2.239   0.110  -1.698  0.00  0.00    +0.036 C 
ATOM     13  C   LIG    1       -1.762  -0.073  -0.246  0.00  0.00    +0.075 C 
ATOM     14  N   LIG    1       -2.564   0.762   0.684  0.00  0.00    -0.305 NA
ATOM     15  H   LIG    1       -2.079   0.750   1.586  0.00  0.00    +0.123 HD
ATOM     16  C   LIG    1       -3.822   0.026   0.889  0.00  0.00    +0.082 C 
ATOM     17  C   LIG    1       -3.490  -1.450   0.727  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1       -2.038  -1.487   0.269  0.00  0.00    +0.031 C 
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  C   LIG    1        3.692  -1.443  -0.022  0.00  0.00    +0.246 C 
ATOM     20  O   LIG    1        4.875  -1.752   0.026  0.00  0.00    -0.270 OA
ATOM     21  N   LIG    1        2.735  -2.416  -0.101  0.00  0.00    -0.325 N 
ATOM     22  H   LIG    1        1.745  -2.184  -0.147  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1        3.025  -3.382  -0.125  0.00  0.00    +0.145 HD
ENDBRANCH   6  19
TORSDOF 2