REMARK  Name = BDB000435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.140   0.215  -0.922  0.00  0.00    +0.035 A 
ATOM      2  C   LIG    1        1.116  -0.096  -1.876  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        2.473   0.098  -1.599  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1        2.889   0.607  -0.362  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        1.906   0.928   0.583  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        0.546   0.734   0.307  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        4.307   0.807  -0.068  0.00  0.00    -0.005 A 
ATOM      8  C   LIG    1        5.166  -0.298   0.164  0.00  0.00    +0.049 A 
ATOM      9  C   LIG    1        6.514  -0.052   0.427  0.00  0.00    +0.068 A 
ATOM     10  N   LIG    1        7.080  -1.286   0.599  0.00  0.00    -0.275 N 
ATOM     11  H   LIG    1        8.050  -1.495   0.800  0.00  0.00    +0.189 HD
ATOM     12  N   LIG    1        6.222  -2.309   0.492  0.00  0.00    -0.158 NA
ATOM     13  C   LIG    1        7.071   1.229   0.481  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1        6.213   2.307   0.260  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        5.060  -1.721   0.226  0.00  0.00    +0.146 A 
ATOM     16  C   LIG    1        4.860   2.103  -0.008  0.00  0.00    +0.009 A 
BRANCH  15  17
ATOM     17  N   LIG    1        3.930  -2.429   0.061  0.00  0.00    -0.341 N 
ATOM     18  H   LIG    1        3.966  -3.385   0.395  0.00  0.00    +0.144 HD
ATOM     19  H   LIG    1        3.039  -1.980   0.245  0.00  0.00    +0.144 HD
ENDBRANCH  15  17
ENDBRANCH   4   7
BRANCH   1  23
ATOM     20  N   LIG    1       -3.476  -0.099  -1.221  0.00  0.00    -0.267 N 
ATOM     21  H   LIG    1       -3.380  -0.091  -2.227  0.00  0.00    +0.156 HD
ATOM     22  C   LIG    1       -2.328   0.103  -0.473  0.00  0.00    +0.308 C 
ATOM     23  N   LIG    1       -1.206  -0.006  -1.282  0.00  0.00    -0.269 N 
ATOM     24  H   LIG    1       -1.357  -0.395  -2.199  0.00  0.00    +0.156 HD
ATOM     25  O   LIG    1       -2.310   0.339   0.727  0.00  0.00    -0.252 OA
BRANCH  20  29
ATOM     26  C   LIG    1       -6.938  -0.213   2.393  0.00  0.00    +0.044 C 
ATOM     27  C   LIG    1       -6.549  -0.192   0.942  0.00  0.00    -0.049 A 
ATOM     28  C   LIG    1       -5.191  -0.141   0.580  0.00  0.00    +0.029 A 
ATOM     29  C   LIG    1       -4.812  -0.148  -0.763  0.00  0.00    +0.070 A 
ATOM     30  C   LIG    1       -5.814  -0.227  -1.738  0.00  0.00    +0.145 A 
ATOM     31  F   LIG    1       -5.471  -0.245  -3.037  0.00  0.00    -0.204 F 
ATOM     32  C   LIG    1       -7.161  -0.293  -1.399  0.00  0.00    +0.040 A 
ATOM     33  C   LIG    1       -7.529  -0.280  -0.055  0.00  0.00    +0.006 A 
ENDBRANCH  20  29
ENDBRANCH   1  23
TORSDOF 4