REMARK  Name = BDB061308
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.983   1.541  -2.265  0.00  0.00    +0.192 C 
ENDROOT
BRANCH   1   5
ATOM      2  N   LIG    1       -2.112   0.900  -0.464  0.00  0.00    -0.246 N 
ATOM      3  C   LIG    1       -1.291   0.792  -1.598  0.00  0.00    +0.316 C 
ATOM      4  O   LIG    1       -1.526   0.217  -2.651  0.00  0.00    -0.252 OA
ATOM      5  N   LIG    1       -0.125   1.465  -1.344  0.00  0.00    -0.217 N 
ATOM      6  C   LIG    1       -0.140   2.021  -0.103  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        0.736   2.705   0.409  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1       -1.449   1.671   0.564  0.00  0.00    +0.211 C 
BRANCH   2  14
ATOM      9  C   LIG    1       -7.387  -1.310   0.300  0.00  0.00    +0.044 C 
ATOM     10  C   LIG    1       -6.014  -0.724   0.126  0.00  0.00    -0.047 A 
ATOM     11  C   LIG    1       -5.393   0.020   1.142  0.00  0.00    -0.046 A 
ATOM     12  C   LIG    1       -6.078   0.265   2.460  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1       -4.104   0.546   0.925  0.00  0.00    +0.027 A 
ATOM     14  C   LIG    1       -3.411   0.353  -0.283  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1       -4.049  -0.391  -1.278  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1       -5.330  -0.921  -1.079  0.00  0.00    +0.005 A 
ENDBRANCH   2  14
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  C   LIG    1        1.818   0.319  -2.123  0.00  0.00    +0.123 A 
ATOM     18  O   LIG    1        2.876   0.397  -1.269  0.00  0.00    -0.458 OA
ATOM     19  C   LIG    1        3.502  -0.819  -1.269  0.00  0.00    +0.135 A 
ATOM     20  C   LIG    1        2.837  -1.671  -2.132  0.00  0.00    +0.050 A 
ATOM     21  C   LIG    1        1.754  -0.940  -2.679  0.00  0.00    +0.047 A 
BRANCH  19  22
ATOM     22  C   LIG    1        4.672  -0.945  -0.403  0.00  0.00    +0.018 A 
ATOM     23  C   LIG    1        5.082   0.114   0.425  0.00  0.00    +0.026 A 
ATOM     24  C   LIG    1        6.206  -0.015   1.254  0.00  0.00    +0.060 A 
ATOM     25  C   LIG    1        6.930  -1.211   1.262  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1        6.535  -2.270   0.447  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        5.415  -2.136  -0.378  0.00  0.00    +0.011 A 
BRANCH  24  28
ATOM     28  C   LIG    1        6.663   1.085   2.138  0.00  0.00    +0.337 C 
ATOM     29  O   LIG    1        7.615   1.038   2.896  0.00  0.00    -0.245 OA
BRANCH  28  30
ATOM     30  O   LIG    1        5.909   2.192   2.030  0.00  0.00    -0.477 OA
ATOM     31  H   LIG    1        6.316   2.823   2.659  0.00  0.00    +0.295 HD
ENDBRANCH  28  30
ENDBRANCH  24  28
ENDBRANCH  19  22
ENDBRANCH   1  17
TORSDOF 6