REMARK  Name = BDB057356
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.526   0.154   0.097  0.00  0.00    +0.190 A 
ATOM      2  N   LIG    1        2.972  -0.998   0.498  0.00  0.00    -0.204 NA
ATOM      3  C   LIG    1        1.621  -1.091   0.512  0.00  0.00    +0.146 A 
ATOM      4  N   LIG    1        1.157  -2.360   0.845  0.00  0.00    -0.321 N 
ATOM      5  H   LIG    1        1.950  -2.979   0.974  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        0.046  -2.940   0.365  0.00  0.00    +0.180 A 
ATOM      7  C   LIG    1       -1.145  -2.271   0.014  0.00  0.00    +0.129 A 
ATOM      8  N   LIG    1       -1.545  -0.952   0.190  0.00  0.00    -0.241 NA
ATOM      9  C   LIG    1       -0.683   0.012   0.305  0.00  0.00    +0.084 A 
ATOM     10  C   LIG    1       -1.999  -3.242  -0.448  0.00  0.00    +0.060 A 
ATOM     11  C   LIG    1       -3.397  -3.187  -0.923  0.00  0.00    +0.067 C 
ATOM     12  N   LIG    1       -1.292  -4.407  -0.353  0.00  0.00    -0.278 N 
ATOM     13  H   LIG    1       -1.598  -5.343  -0.593  0.00  0.00    +0.189 HD
ATOM     14  N   LIG    1       -0.052  -4.254   0.142  0.00  0.00    -0.154 NA
ATOM     15  C   LIG    1        0.806  -0.021   0.193  0.00  0.00    +0.061 A 
ATOM     16  C   LIG    1        1.486   1.109  -0.235  0.00  0.00    +0.127 A 
ATOM     17  N   LIG    1        2.829   1.226  -0.292  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   9  18
ATOM     18  C   LIG    1       -1.310   1.344   0.591  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -2.324   1.814  -0.250  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1       -2.914   3.053   0.003  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -2.500   3.812   1.099  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -1.503   3.332   1.951  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -0.909   2.093   1.704  0.00  0.00    +0.010 A 
ENDBRANCH   9  18
BRANCH   1  25
ATOM     24  C   LIG    1        5.569   1.833  -0.673  0.00  0.00    +0.093 C 
ATOM     25  S   LIG    1        5.300   0.217   0.096  0.00  0.00    -0.089 S 
ENDBRANCH   1  25
TORSDOF 2