REMARK  Name = BDB032718
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.882   0.612  -1.587  0.00  0.00    -0.010 A 
ATOM      2  C   LIG    1       -1.629   0.737  -0.406  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.774  -0.029  -0.286  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -3.727  -0.097   0.826  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -4.762  -0.936   0.427  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -4.437  -1.615  -0.827  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1       -3.590   0.480   1.887  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -3.197  -0.914  -1.272  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -2.467  -1.062  -2.436  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1       -1.305  -0.294  -2.589  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -5.780  -1.433   1.360  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -6.759  -2.412   0.691  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -6.446  -3.564   0.389  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -7.970  -1.901   0.290  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -8.565  -2.533  -0.229  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -8.354  -0.584   0.274  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -9.351  -0.228  -0.348  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.457   0.394   0.993  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -6.593  -0.315   2.024  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1        0.388   1.407  -1.765  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        1.428   0.723  -1.062  0.00  0.00    -0.445 OA
BRANCH  21  24
ATOM     22  N   LIG    1        3.538   0.577  -0.454  0.00  0.00    -0.251 N 
ATOM     23  H   LIG    1        3.120  -0.224  -0.001  0.00  0.00    +0.158 HD
ATOM     24  C   LIG    1        2.644   1.317  -1.173  0.00  0.00    +0.405 C 
ATOM     25  O   LIG    1        2.847   2.334  -1.817  0.00  0.00    -0.226 OA
BRANCH  22  31
ATOM     26  C   LIG    1        6.988   0.023   0.756  0.00  0.00    +0.125 A 
ATOM     27  C   LIG    1        7.678   1.100   0.176  0.00  0.00    -0.009 A 
ATOM     28  C   LIG    1        9.154   1.282   0.402  0.00  0.00    +0.047 C 
ATOM     29  C   LIG    1        6.978   2.013  -0.622  0.00  0.00    +0.009 A 
ATOM     30  C   LIG    1        5.607   1.863  -0.845  0.00  0.00    +0.024 A 
ATOM     31  C   LIG    1        4.915   0.797  -0.274  0.00  0.00    +0.040 A 
ATOM     32  C   LIG    1        5.614  -0.121   0.526  0.00  0.00    +0.069 A 
BRANCH  26  34
ATOM     33  C   LIG    1        7.090  -1.918   2.145  0.00  0.00    +0.277 C 
ATOM     34  O   LIG    1        7.748  -0.824   1.521  0.00  0.00    -0.495 OA
ENDBRANCH  26  34
ENDBRANCH  22  31
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 6