REMARK  Name = BDB033094
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.040  -1.643   1.297  0.00  0.00    +0.099 C 
ATOM      2  C   LIG    1       -0.861  -1.531   0.068  0.00  0.00    +0.131 C 
ATOM      3  N   LIG    1       -1.539  -0.265   0.200  0.00  0.00    -0.293 N 
ATOM      4  C   LIG    1       -1.417   0.262   1.473  0.00  0.00    +0.218 C 
ATOM      5  O   LIG    1       -1.951   1.264   1.921  0.00  0.00    -0.276 OA
ATOM      6  C   LIG    1       -0.536  -0.644   2.295  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -2.381   0.242  -0.872  0.00  0.00    +0.107 C 
ATOM      8  C   LIG    1       -3.840  -0.075  -0.695  0.00  0.00    -0.024 A 
ATOM      9  C   LIG    1       -4.585   1.086  -0.459  0.00  0.00    -0.042 A 
ATOM     10  C   LIG    1       -5.955   1.030  -0.257  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -6.585  -0.214  -0.312  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -5.844  -1.379  -0.561  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -3.708   2.298  -0.416  0.00  0.00    +0.037 C 
ATOM     14  C   LIG    1       -4.462  -1.314  -0.754  0.00  0.00    +0.006 A 
ATOM     15  C   LIG    1       -2.401   1.778  -1.035  0.00  0.00    +0.032 C 
ENDBRANCH   3   7
BRANCH   1  17
ATOM     16  C   LIG    1        2.025  -0.370   0.406  0.00  0.00    +0.248 C 
ATOM     17  N   LIG    1        1.466  -1.452   1.046  0.00  0.00    -0.306 N 
ATOM     18  H   LIG    1        2.120  -2.070   1.523  0.00  0.00    +0.149 HD
ATOM     19  O   LIG    1        1.355   0.503  -0.135  0.00  0.00    -0.270 OA
BRANCH  16  23
ATOM     20  C   LIG    1        6.059   2.087  -1.202  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1        5.479   0.954  -0.408  0.00  0.00    -0.050 A 
ATOM     22  C   LIG    1        4.090   0.782  -0.331  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        3.522  -0.289   0.383  0.00  0.00    +0.078 A 
ATOM     24  C   LIG    1        4.381  -1.199   1.018  0.00  0.00    +0.129 A 
ATOM     25  C   LIG    1        5.769  -1.045   0.934  0.00  0.00    +0.046 A 
ATOM     26  C   LIG    1        6.313   0.024   0.219  0.00  0.00    +0.007 A 
BRANCH  24  27
ATOM     27  O   LIG    1        3.885  -2.258   1.737  0.00  0.00    -0.506 OA
ATOM     28  H   LIG    1        4.633  -2.751   2.118  0.00  0.00    +0.292 HD
ENDBRANCH  24  27
ENDBRANCH  16  23
ENDBRANCH   1  17
TORSDOF 4