REMARK  Name = BDB003204
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.315  -1.432  -0.347  0.00  0.00    -0.284 N 
ATOM      2  H   LIG    1       -0.003  -1.847   0.520  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        0.470  -1.652  -1.472  0.00  0.00    +0.231 C 
ATOM      4  O   LIG    1        0.240  -1.251  -2.609  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1  10
ATOM      5  C   LIG    1       -5.160   1.591   0.226  0.00  0.00    +0.044 C 
ATOM      6  C   LIG    1       -3.892   0.795   0.085  0.00  0.00    -0.047 A 
ATOM      7  C   LIG    1       -3.309   0.135   1.182  0.00  0.00    -0.046 A 
ATOM      8  C   LIG    1       -3.928   0.197   2.551  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -2.122  -0.596   0.992  0.00  0.00    +0.027 A 
ATOM     10  C   LIG    1       -1.508  -0.682  -0.265  0.00  0.00    +0.034 A 
ATOM     11  C   LIG    1       -2.093  -0.026  -1.343  0.00  0.00    +0.023 A 
ATOM     12  C   LIG    1       -3.273   0.705  -1.170  0.00  0.00    +0.005 A 
ENDBRANCH   1  10
BRANCH   3  13
ATOM     13  C   LIG    1        1.737  -2.456  -1.151  0.00  0.00    +0.178 C 
BRANCH  13  14
ATOM     14  N   LIG    1        2.966  -1.638  -1.195  0.00  0.00    -0.304 NA
ATOM     15  H   LIG    1        3.761  -2.271  -1.094  0.00  0.00    +0.123 HD
BRANCH  14  16
ATOM     16  C   LIG    1        3.018  -0.571  -0.192  0.00  0.00    +0.077 C 
ATOM     17  C   LIG    1        4.460  -0.290   0.250  0.00  0.00    +0.184 C 
ATOM     18  S   LIG    1        4.360   1.283   1.081  0.00  0.00    -0.029 S 
ATOM     19  O   LIG    1        5.445   2.125   0.623  0.00  0.00    -0.174 OA
ATOM     20  O   LIG    1        4.114   1.035   2.487  0.00  0.00    -0.174 OA
ATOM     21  C   LIG    1        2.833   1.817   0.326  0.00  0.00    +0.167 C 
ATOM     22  C   LIG    1        2.527   0.778  -0.747  0.00  0.00    +0.043 C 
ENDBRANCH  14  16
ENDBRANCH  13  14
ENDBRANCH   3  13
TORSDOF 4