REMARK  Name = BDB011564
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.145  -1.208  -0.858  0.00  0.00    +0.241 C 
ATOM      2  N   LIG    1       -0.233  -0.920  -1.858  0.00  0.00    -0.257 N 
ATOM      3  C   LIG    1        1.150  -1.459  -2.012  0.00  0.00    +0.171 C 
ATOM      4  C   LIG    1        1.564  -1.191  -3.472  0.00  0.00    +0.069 C 
ATOM      5  C   LIG    1        0.551  -0.174  -3.894  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        0.542   0.558  -5.072  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1       -0.534   1.412  -5.311  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1       -1.581   1.510  -4.384  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -1.565   0.759  -3.204  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -0.487  -0.077  -2.966  0.00  0.00    +0.040 A 
ATOM     11  O   LIG    1       -2.262  -0.681  -0.778  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   3  12
ATOM     12  C   LIG    1        2.188  -0.782  -1.099  0.00  0.00    +0.235 C 
ATOM     13  N   LIG    1        1.892   0.499  -0.702  0.00  0.00    -0.310 N 
ATOM     14  H   LIG    1        0.918   0.782  -0.720  0.00  0.00    +0.149 HD
ATOM     15  O   LIG    1        3.273  -1.318  -0.874  0.00  0.00    -0.274 OA
BRANCH  13  16
ATOM     16  C   LIG    1        2.765   1.203   0.206  0.00  0.00    +0.139 C 
BRANCH  16  17
ATOM     17  C   LIG    1        2.228   2.575   0.511  0.00  0.00    -0.030 A 
ATOM     18  C   LIG    1        2.238   3.579  -0.469  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        1.723   4.846  -0.190  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        1.191   5.121   1.069  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        1.171   4.129   2.048  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        1.684   2.861   1.770  0.00  0.00    +0.005 A 
ENDBRANCH  16  17
ENDBRANCH  13  16
ENDBRANCH   3  12
BRANCH   1  23
ATOM     23  C   LIG    1       -0.764  -2.278   0.199  0.00  0.00    +0.162 C 
BRANCH  23  25
ATOM     24  C   LIG    1       -0.562  -0.878   2.235  0.00  0.00    +0.230 C 
ATOM     25  N   LIG    1       -1.300  -1.748   1.461  0.00  0.00    -0.302 N 
ATOM     26  H   LIG    1       -2.304  -1.599   1.465  0.00  0.00    +0.150 HD
ATOM     27  O   LIG    1        0.619  -0.624   2.005  0.00  0.00    -0.274 OA
BRANCH  24  28
ATOM     28  C   LIG    1       -1.362  -0.207   3.376  0.00  0.00    +0.137 C 
ATOM     29  C   LIG    1       -1.962   1.088   2.828  0.00  0.00    +0.034 C 
BRANCH  28  31
ATOM     30  C   LIG    1       -1.055   0.697   5.638  0.00  0.00    +0.101 C 
ATOM     31  N   LIG    1       -0.465  -0.032   4.531  0.00  0.00    -0.309 NA
ATOM     32  H   LIG    1        0.395   0.422   4.215  0.00  0.00    +0.122 HD
ENDBRANCH  28  31
ENDBRANCH  24  28
ENDBRANCH  23  25
BRANCH  23  33
ATOM     33  C   LIG    1       -1.438  -3.637  -0.115  0.00  0.00    +0.012 C 
ATOM     34  C   LIG    1       -1.158  -4.660   0.995  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -1.004  -4.235  -1.454  0.00  0.00    +0.009 C 
ENDBRANCH  23  33
ENDBRANCH   1  23
TORSDOF 8