REMARK  Name = BDB064932
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.213  -1.188  -0.260  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        1.246  -1.053   0.674  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1        2.402  -1.868   0.653  0.00  0.00    -0.035 A 
ATOM      4  C   LIG    1        2.469  -2.832  -0.373  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.450  -2.980  -1.314  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        0.326  -2.159  -1.256  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1       -1.307   0.607   0.614  0.00  0.00    +0.267 C 
ATOM      8  N   LIG    1       -0.947  -0.396  -0.266  0.00  0.00    -0.280 N 
ATOM      9  H   LIG    1       -1.634  -0.571  -0.997  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1       -0.677   1.005   1.585  0.00  0.00    -0.268 OA
BRANCH   7  16
ATOM     11  C   LIG    1       -4.990   3.851   1.455  0.00  0.00    +0.066 C 
ATOM     12  C   LIG    1       -4.344   2.744   0.679  0.00  0.00    +0.042 A 
ATOM     13  N   LIG    1       -5.004   2.274  -0.401  0.00  0.00    -0.237 NA
ATOM     14  C   LIG    1       -4.447   1.275  -1.117  0.00  0.00    +0.133 A 
ATOM     15  N   LIG    1       -3.258   0.728  -0.812  0.00  0.00    -0.227 NA
ATOM     16  C   LIG    1       -2.630   1.229   0.280  0.00  0.00    +0.129 A 
ATOM     17  C   LIG    1       -3.127   2.241   1.068  0.00  0.00    +0.056 A 
BRANCH  14  18
ATOM     18  C   LIG    1       -5.191   0.756  -2.323  0.00  0.00    +0.057 C 
ATOM     19  C   LIG    1       -5.459  -0.725  -2.476  0.00  0.00    +0.012 C 
ATOM     20  C   LIG    1       -6.592   0.209  -2.171  0.00  0.00    +0.012 C 
ENDBRANCH  14  18
ENDBRANCH   7  16
ENDBRANCH   1   8
BRANCH   3  21
ATOM     21  C   LIG    1        3.584  -1.695   1.728  0.00  0.00    +0.048 C 
ATOM     22  C   LIG    1        3.212  -1.365   3.201  0.00  0.00    +0.174 C 
ATOM     23  O   LIG    1        4.082  -2.419   3.692  0.00  0.00    -0.378 OA
ATOM     24  C   LIG    1        4.118  -3.006   2.371  0.00  0.00    +0.174 C 
BRANCH  21  25
ATOM     25  C   LIG    1        4.742  -0.850   1.164  0.00  0.00    +0.075 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.360   0.555   0.832  0.00  0.00    +0.087 A 
ATOM     27  C   LIG    1        3.978   1.116  -0.420  0.00  0.00    +0.011 A 
ATOM     28  C   LIG    1        3.840   0.464  -1.740  0.00  0.00    +0.049 C 
ATOM     29  C   LIG    1        3.739   2.436  -0.119  0.00  0.00    +0.233 A 
ATOM     30  O   LIG    1        3.974   2.661   1.194  0.00  0.00    -0.362 OA
ATOM     31  N   LIG    1        4.373   1.486   1.796  0.00  0.00    -0.083 NA
ENDBRANCH  25  26
ENDBRANCH  21  25
ENDBRANCH   3  21
TORSDOF 6