REMARK  Name = BDB065429
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.213   1.810   2.041  0.00  0.00    +0.029 C 
ATOM      2  C   LIG    1       -3.372   1.557   0.536  0.00  0.00    +0.089 C 
ATOM      3  N   LIG    1       -2.496   0.497   0.033  0.00  0.00    -0.250 N 
ATOM      4  C   LIG    1       -3.057  -0.417  -0.877  0.00  0.00    +0.309 C 
ATOM      5  N   LIG    1       -4.138  -1.153  -0.422  0.00  0.00    -0.285 N 
ATOM      6  C   LIG    1       -4.373  -1.494   0.980  0.00  0.00    +0.113 C 
ATOM      7  C   LIG    1       -5.416  -2.567   0.940  0.00  0.00    +0.011 C 
ATOM      8  C   LIG    1       -5.661  -2.934  -0.482  0.00  0.00    +0.011 C 
ATOM      9  C   LIG    1       -6.774  -2.322   0.330  0.00  0.00    +0.010 C 
ATOM     10  C   LIG    1       -4.752  -2.109  -1.337  0.00  0.00    +0.113 C 
ATOM     11  O   LIG    1       -2.607  -0.580  -2.013  0.00  0.00    -0.252 OA
ATOM     12  C   LIG    1       -1.071   0.701  -0.032  0.00  0.00    +0.059 A 
ATOM     13  C   LIG    1       -0.386   1.923   0.124  0.00  0.00    +0.056 A 
ATOM     14  C   LIG    1        1.026   1.917   0.163  0.00  0.00    +0.038 A 
ATOM     15  C   LIG    1        1.770   0.743   0.004  0.00  0.00    +0.039 A 
ATOM     16  C   LIG    1        1.103  -0.463  -0.161  0.00  0.00    +0.015 A 
ATOM     17  N   LIG    1       -0.930   3.219   0.213  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1       -0.280   3.978   0.386  0.00  0.00    +0.155 HD
ATOM     19  C   LIG    1       -2.182   3.703   0.033  0.00  0.00    +0.219 C 
ATOM     20  O   LIG    1       -2.364   4.918   0.143  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1       -0.293  -0.475  -0.175  0.00  0.00    +0.026 A 
ATOM     22  C   LIG    1       -3.307   2.797  -0.336  0.00  0.00    +0.118 C 
ENDROOT
BRANCH  15  23
ATOM     23  C   LIG    1        3.254   0.832   0.045  0.00  0.00    +0.244 C 
ATOM     24  N   LIG    1        3.945  -0.108  -0.690  0.00  0.00    -0.311 N 
ATOM     25  H   LIG    1        3.446  -0.727  -1.314  0.00  0.00    +0.149 HD
ATOM     26  O   LIG    1        3.793   1.724   0.688  0.00  0.00    -0.270 OA
BRANCH  24  27
ATOM     27  C   LIG    1        5.396  -0.103  -0.757  0.00  0.00    +0.105 C 
BRANCH  27  28
ATOM     28  C   LIG    1        6.024  -0.769   0.466  0.00  0.00    +0.022 C 
BRANCH  28  29
ATOM     29  C   LIG    1        7.520  -0.919   0.455  0.00  0.00    -0.009 C 
ATOM     30  C   LIG    1        8.250  -1.527  -0.716  0.00  0.00    +0.004 C 
ATOM     31  C   LIG    1        8.442  -0.071  -0.385  0.00  0.00    +0.004 C 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  24  27
ENDBRANCH  15  23
TORSDOF 4