REMARK  Name = BDB060497
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.302  -1.509  -0.577  0.00  0.00    +0.097 A 
ATOM      2  C   LIG    1       -1.041  -1.322  -0.276  0.00  0.00    +0.077 A 
ATOM      3  N   LIG    1       -1.663  -2.389  -0.893  0.00  0.00    -0.333 N 
ATOM      4  C   LIG    1       -3.062  -2.739  -0.831  0.00  0.00    +0.150 C 
ATOM      5  C   LIG    1       -0.712  -3.111  -1.556  0.00  0.00    +0.200 A 
ATOM      6  N   LIG    1        0.487  -2.612  -1.377  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1       -1.724  -0.325   0.555  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1       -2.585   0.662   0.010  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1       -3.216   1.540   0.923  0.00  0.00    +0.074 A 
ATOM     10  C   LIG    1       -4.072   2.516   0.440  0.00  0.00    +0.066 A 
ATOM     11  C   LIG    1       -4.311   2.651  -0.921  0.00  0.00    +0.125 A 
ATOM     12  C   LIG    1       -3.698   1.816  -1.839  0.00  0.00    +0.039 A 
ATOM     13  F   LIG    1       -5.144   3.607  -1.354  0.00  0.00    -0.205 F 
ATOM     14  N   LIG    1       -3.024   1.475   2.249  0.00  0.00    -0.255 NA
ATOM     15  C   LIG    1       -2.177   0.542   2.727  0.00  0.00    +0.112 A 
ATOM     16  C   LIG    1       -2.836   0.826  -1.377  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1       -1.515  -0.370   1.934  0.00  0.00    +0.030 A 
ENDBRANCH   2   7
BRANCH   1  20
ATOM     18  C   LIG    1        0.864   1.181  -1.729  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1        1.674   0.574  -0.616  0.00  0.00    -0.041 A 
ATOM     20  C   LIG    1        1.411  -0.706  -0.083  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1        2.240  -1.225   0.940  0.00  0.00    -0.041 A 
ATOM     22  C   LIG    1        2.045  -2.614   1.489  0.00  0.00    +0.044 C 
ATOM     23  C   LIG    1        3.295  -0.443   1.441  0.00  0.00    +0.009 A 
ATOM     24  C   LIG    1        3.537   0.845   0.951  0.00  0.00    -0.033 A 
ATOM     25  C   LIG    1        2.721   1.340  -0.074  0.00  0.00    +0.009 A 
BRANCH  24  26
ATOM     26  C   LIG    1        4.660   1.684   1.505  0.00  0.00    +0.113 C 
BRANCH  26  27
ATOM     27  N   LIG    1        5.679   1.947   0.497  0.00  0.00    -0.326 NA
ATOM     28  H   LIG    1        6.005   1.056   0.122  0.00  0.00    +0.119 HD
ATOM     29  H   LIG    1        6.483   2.386   0.940  0.00  0.00    +0.119 HD
ENDBRANCH  26  27
ENDBRANCH  24  26
ENDBRANCH   1  20
TORSDOF 4