REMARK  Name = BDB026340
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.140  -0.041  -0.730  0.00  0.00    -0.326 N 
ATOM      2  C   LIG    1        1.687  -0.448  -2.071  0.00  0.00    +0.120 C 
ATOM      3  C   LIG    1        0.601   0.512  -2.614  0.00  0.00    +0.103 C 
ATOM      4  N   LIG    1       -0.585   0.699  -1.753  0.00  0.00    -0.295 NA
ATOM      5  C   LIG    1       -0.244   0.500  -0.324  0.00  0.00    +0.103 C 
ATOM      6  C   LIG    1        1.225   0.825   0.034  0.00  0.00    +0.120 C 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        6.017  -0.814   0.640  0.00  0.00    +0.125 A 
ATOM      8  N   LIG    1        5.315   0.192   1.207  0.00  0.00    -0.249 NA
ATOM      9  C   LIG    1        4.060   0.409   0.730  0.00  0.00    +0.134 A 
ATOM     10  C   LIG    1        3.426  -0.306  -0.294  0.00  0.00    +0.048 A 
ATOM     11  C   LIG    1        4.199  -1.336  -0.840  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        5.495  -1.597  -0.381  0.00  0.00    +0.035 A 
BRANCH   7  16
ATOM     13  C   LIG    1        7.488   0.752   2.860  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        8.012  -0.373   2.124  0.00  0.00    -0.313 N 
ATOM     15  H   LIG    1        8.948  -0.690   2.340  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.410  -1.106   1.126  0.00  0.00    +0.262 C 
ATOM     17  O   LIG    1        8.051  -2.032   0.623  0.00  0.00    -0.269 OA
ENDBRANCH   7  16
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  C   LIG    1       -1.698  -0.166  -2.170  0.00  0.00    +0.119 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.999   0.155  -1.461  0.00  0.00    -0.031 A 
ATOM     20  C   LIG    1       -3.634  -0.804  -0.660  0.00  0.00    +0.032 A 
ATOM     21  C   LIG    1       -4.833  -0.488  -0.018  0.00  0.00    +0.068 A 
ATOM     22  C   LIG    1       -5.423   0.776  -0.160  0.00  0.00    +0.088 A 
ATOM     23  N   LIG    1       -6.629   1.119   0.476  0.00  0.00    -0.236 NA
ATOM     24  C   LIG    1       -7.213   0.218   1.223  0.00  0.00    +0.209 A 
ATOM     25  C   LIG    1       -6.647  -1.169   1.430  0.00  0.00    +0.279 A 
ATOM     26  O   LIG    1       -7.217  -1.988   2.133  0.00  0.00    -0.266 OA
ATOM     27  C   LIG    1       -4.790   1.727  -0.958  0.00  0.00    +0.030 A 
ATOM     28  N   LIG    1       -5.467  -1.442   0.782  0.00  0.00    -0.319 N 
ATOM     29  H   LIG    1       -5.073  -2.365   0.908  0.00  0.00    +0.169 HD
ATOM     30  C   LIG    1       -3.589   1.421  -1.604  0.00  0.00    +0.007 A 
BRANCH  24  31
ATOM     31  C   LIG    1       -8.503   0.466   1.951  0.00  0.00    +0.439 C 
ATOM     32  F   LIG    1       -8.379   0.336   3.301  0.00  0.00    -0.164 F 
ATOM     33  F   LIG    1       -8.992   1.724   1.747  0.00  0.00    -0.164 F 
ATOM     34  F   LIG    1       -9.498  -0.380   1.563  0.00  0.00    -0.164 F 
ENDBRANCH  24  31
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 5