REMARK  Name = BDB060668
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.987  -1.799  -0.877  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1        2.320  -1.454  -0.504  0.00  0.00    +0.117 A 
ATOM      3  C   LIG    1        3.134  -2.480  -0.962  0.00  0.00    +0.154 A 
ATOM      4  C   LIG    1        4.508  -2.485  -0.782  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1        5.017  -1.377  -0.101  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1        4.155  -0.365   0.344  0.00  0.00    +0.093 A 
ATOM      7  O   LIG    1        2.394  -3.434  -1.583  0.00  0.00    -0.461 OA
ATOM      8  N   LIG    1        2.811  -0.374   0.156  0.00  0.00    -0.241 NA
ATOM      9  C   LIG    1        1.100  -3.019  -1.522  0.00  0.00    +0.206 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1       -2.739   0.265  -0.181  0.00  0.00    -0.042 A 
ATOM     11  C   LIG    1       -2.589  -0.636  -1.251  0.00  0.00    +0.005 A 
ATOM     12  C   LIG    1       -1.381  -1.308  -1.483  0.00  0.00    +0.009 A 
ATOM     13  C   LIG    1       -0.275  -1.105  -0.651  0.00  0.00    -0.013 A 
ATOM     14  C   LIG    1       -0.412  -0.207   0.411  0.00  0.00    +0.009 A 
ATOM     15  C   LIG    1       -1.622   0.465   0.643  0.00  0.00    +0.005 A 
BRANCH  10  17
ATOM     16  C   LIG    1       -5.196  -0.054   0.273  0.00  0.00    +0.015 C 
ATOM     17  C   LIG    1       -4.079   0.986   0.043  0.00  0.00    -0.013 C 
ATOM     18  C   LIG    1       -4.424   1.836  -1.199  0.00  0.00    +0.015 C 
ATOM     19  C   LIG    1       -4.080   1.935   1.262  0.00  0.00    +0.015 C 
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  C   LIG    1        4.689   0.800   1.060  0.00  0.00    +0.130 A 
ATOM     21  N   LIG    1        3.963   1.549   1.914  0.00  0.00    -0.153 NA
ATOM     22  N   LIG    1        4.845   2.478   2.305  0.00  0.00    -0.196 N 
ATOM     23  H   LIG    1        4.576   3.210   2.958  0.00  0.00    +0.213 HD
ATOM     24  N   LIG    1        6.092   2.414   1.814  0.00  0.00    -0.163 NA
ATOM     25  C   LIG    1        5.994   1.350   1.011  0.00  0.00    +0.166 A 
ENDBRANCH   6  20
TORSDOF 3