REMARK  Name = BDB000768
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.887   0.535  -0.158  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        2.036  -0.293   0.050  0.00  0.00    +0.100 A 
ATOM      3  N   LIG    1        3.164   0.391  -0.217  0.00  0.00    -0.171 NA
ATOM      4  N   LIG    1        2.746   1.625  -0.540  0.00  0.00    -0.268 N 
ATOM      5  C   LIG    1        1.393   1.763  -0.529  0.00  0.00    +0.117 A 
ENDROOT
BRANCH   1  10
ATOM      6  C   LIG    1       -4.741  -0.421   0.292  0.00  0.00    +0.180 C 
ATOM      7  C   LIG    1       -3.265  -0.301   0.028  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1       -2.731   0.791   0.725  0.00  0.00    -0.041 A 
ATOM      9  C   LIG    1       -1.376   1.082   0.680  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1       -0.537   0.261  -0.087  0.00  0.00    -0.014 A 
ATOM     11  C   LIG    1       -1.077  -0.837  -0.785  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1       -3.795   1.498   1.507  0.00  0.00    +0.038 C 
ATOM     13  C   LIG    1       -2.444  -1.129  -0.723  0.00  0.00    +0.007 A 
ATOM     14  C   LIG    1       -5.067   0.991   0.813  0.00  0.00    +0.040 C 
BRANCH   6  16
ATOM     15  O   LIG    1       -6.250  -1.719  -0.793  0.00  0.00    -0.148 OA
ATOM     16  N   LIG    1       -5.536  -0.719  -0.932  0.00  0.00    -0.061 NA
ENDBRANCH   6  16
ENDBRANCH   1  10
BRANCH   2  17
ATOM     17  C   LIG    1        2.107  -1.690   0.483  0.00  0.00    +0.006 A 
ATOM     18  C   LIG    1        3.086  -2.537  -0.044  0.00  0.00    +0.030 A 
ATOM     19  C   LIG    1        3.124  -3.853   0.383  0.00  0.00    +0.111 A 
ATOM     20  N   LIG    1        2.267  -4.373   1.288  0.00  0.00    -0.263 NA
ATOM     21  C   LIG    1        1.341  -3.534   1.797  0.00  0.00    +0.111 A 
ATOM     22  C   LIG    1        1.223  -2.202   1.434  0.00  0.00    +0.030 A 
ENDBRANCH   2  17
BRANCH   4  23
ATOM     23  C   LIG    1        3.721   2.644  -0.883  0.00  0.00    +0.171 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.300   2.430  -2.275  0.00  0.00    +0.179 C 
BRANCH  24  25
ATOM     25  O   LIG    1        3.344   2.749  -3.286  0.00  0.00    -0.393 OA
ATOM     26  H   LIG    1        2.723   1.999  -3.341  0.00  0.00    +0.209 HD
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   4  23
TORSDOF 6