REMARK  Name = BDB064446
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.994   2.789  -0.799  0.00  0.00    +0.001 A 
ATOM      2  C   LIG    1       -3.619   2.551  -0.821  0.00  0.00    +0.008 A 
ATOM      3  C   LIG    1       -3.090   1.336  -0.351  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -3.967   0.351   0.139  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1       -3.437  -0.864   0.593  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1       -2.049  -1.121   0.583  0.00  0.00    +0.044 A 
ATOM      7  C   LIG    1       -1.153  -0.124   0.118  0.00  0.00    +0.039 A 
ATOM      8  C   LIG    1       -5.349   0.603   0.154  0.00  0.00    +0.008 A 
ATOM      9  C   LIG    1       -1.707   1.078  -0.366  0.00  0.00    +0.032 A 
ATOM     10  C   LIG    1       -5.859   1.816  -0.311  0.00  0.00    +0.001 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1       -1.589  -2.418   1.085  0.00  0.00    +0.206 A 
ATOM     12  N   LIG    1       -2.381  -3.490   1.285  0.00  0.00    -0.133 NA
ATOM     13  N   LIG    1       -1.482  -4.371   1.744  0.00  0.00    -0.176 N 
ATOM     14  H   LIG    1       -1.735  -5.323   1.992  0.00  0.00    +0.214 HD
ATOM     15  N   LIG    1       -0.228  -3.926   1.865  0.00  0.00    -0.049 NA
ATOM     16  N   LIG    1       -0.281  -2.671   1.448  0.00  0.00    -0.108 NA
ENDBRANCH   6  11
BRANCH   7  17
ATOM     17  N   LIG    1        0.228  -0.377   0.000  0.00  0.00    -0.343 N 
ATOM     18  H   LIG    1        0.521  -1.144   0.612  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.179   0.732   0.015  0.00  0.00    +0.105 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.618   0.198   0.096  0.00  0.00    +0.008 C 
ATOM     21  C   LIG    1        2.981  -0.681  -1.120  0.00  0.00    +0.020 C 
ATOM     22  C   LIG    1        4.447  -0.553  -1.541  0.00  0.00    +0.081 C 
ATOM     23  N   LIG    1        5.314  -0.411  -0.380  0.00  0.00    -0.316 NA
ATOM     24  H   LIG    1        6.294  -0.447  -0.659  0.00  0.00    +0.122 HD
ATOM     25  C   LIG    1        5.055   0.821   0.365  0.00  0.00    +0.081 C 
ATOM     26  C   LIG    1        3.622   1.348   0.232  0.00  0.00    +0.020 C 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   7  17
TORSDOF 4