REMARK  Name = BDB033954
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.883  -2.440  -0.465  0.00  0.00    +0.166 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1       -1.591  -4.655  -1.355  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -0.677  -3.875  -0.693  0.00  0.00    -0.304 N 
ATOM      4  H   LIG    1        0.208  -4.264  -0.380  0.00  0.00    +0.149 HD
ATOM      5  O   LIG    1       -2.656  -4.220  -1.778  0.00  0.00    -0.276 OA
BRANCH   2   7
ATOM      6  C   LIG    1       -2.166  -6.947  -2.232  0.00  0.00    +0.013 C 
ATOM      7  C   LIG    1       -1.145  -6.096  -1.498  0.00  0.00    +0.092 C 
ENDBRANCH   2   7
ENDBRANCH   1   3
BRANCH   1   8
ATOM      8  C   LIG    1        0.510  -1.849  -0.165  0.00  0.00    +0.234 C 
ATOM      9  N   LIG    1        0.632  -0.500  -0.409  0.00  0.00    -0.309 N 
ATOM     10  H   LIG    1       -0.249   0.009  -0.513  0.00  0.00    +0.149 HD
ATOM     11  O   LIG    1        1.432  -2.541   0.269  0.00  0.00    -0.274 OA
BRANCH   9  12
ATOM     12  C   LIG    1        1.801   0.274   0.021  0.00  0.00    +0.091 C 
BRANCH  12  13
ATOM     13  C   LIG    1        1.885   1.568  -0.817  0.00  0.00    +0.058 C 
BRANCH  13  14
ATOM     14  C   LIG    1        3.292   2.061  -1.063  0.00  0.00    -0.046 A 
ATOM     15  C   LIG    1        4.140   1.372  -1.942  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        5.439   1.826  -2.176  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        5.904   2.971  -1.534  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        5.071   3.665  -0.659  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        3.770   3.213  -0.425  0.00  0.00    +0.004 A 
ENDBRANCH  13  14
ENDBRANCH  12  13
BRANCH  12  20
ATOM     20  C   LIG    1        1.704   0.539   1.550  0.00  0.00    +0.100 C 
BRANCH  20  21
ATOM     21  N   LIG    1        2.781   1.344   2.119  0.00  0.00    -0.328 NA
ATOM     22  H   LIG    1        3.681   0.963   1.821  0.00  0.00    +0.118 HD
ATOM     23  H   LIG    1        2.762   1.260   3.135  0.00  0.00    +0.118 HD
ENDBRANCH  20  21
ENDBRANCH  12  20
ENDBRANCH   9  12
ENDBRANCH   1   8
BRANCH   1  24
ATOM     24  C   LIG    1       -1.850  -2.192   0.698  0.00  0.00    +0.109 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -2.178  -0.765   0.967  0.00  0.00    +0.153 A 
ATOM     26  N   LIG    1       -2.033   0.221   0.074  0.00  0.00    -0.154 NA
ATOM     27  N   LIG    1       -2.463   1.301   0.770  0.00  0.00    -0.247 N 
ATOM     28  C   LIG    1       -2.804   0.944   2.050  0.00  0.00    +0.125 A 
ATOM     29  C   LIG    1       -3.285   1.858   3.110  0.00  0.00    +0.088 C 
ATOM     30  N   LIG    1       -2.622  -0.353   2.191  0.00  0.00    -0.216 NA
BRANCH  27  31
ATOM     31  C   LIG    1       -2.487   2.595   0.101  0.00  0.00    +0.103 C 
ATOM     32  C   LIG    1       -1.710   3.679   0.845  0.00  0.00    +0.032 C 
ATOM     33  C   LIG    1       -3.909   3.038  -0.236  0.00  0.00    +0.032 C 
ENDBRANCH  27  31
ENDBRANCH  24  25
ENDBRANCH   1  24
TORSDOF 11