REMARK  Name = BDB033434
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.127  -2.771   1.437  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -2.491  -2.050   0.278  0.00  0.00    -0.040 A 
ATOM      3  C   LIG    1       -2.297  -0.642   0.249  0.00  0.00    +0.022 A 
ATOM      4  C   LIG    1       -1.693  -0.065  -0.875  0.00  0.00    +0.071 A 
ATOM      5  N   LIG    1       -1.641   1.297  -0.661  0.00  0.00    -0.358 N 
ATOM      6  H   LIG    1       -1.252   1.965  -1.317  0.00  0.00    +0.165 HD
ATOM      7  C   LIG    1       -2.155   1.605   0.568  0.00  0.00    +0.102 A 
ATOM      8  C   LIG    1       -1.271  -0.818  -1.978  0.00  0.00    +0.072 A 
ATOM      9  C   LIG    1       -1.451  -2.199  -1.934  0.00  0.00    +0.027 A 
ATOM     10  C   LIG    1       -2.575   0.432   1.154  0.00  0.00    +0.077 A 
ATOM     11  C   LIG    1       -2.053  -2.802  -0.832  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   8  12
ATOM     12  N   LIG    1       -0.589  -0.205  -3.076  0.00  0.00    -0.211 N 
ATOM     13  H   LIG    1       -0.821  -0.634  -3.974  0.00  0.00    +0.174 HD
BRANCH  12  14
ATOM     14  S   LIG    1        1.114  -0.191  -2.962  0.00  0.00    +0.108 S 
ATOM     15  O   LIG    1        1.602   0.484  -4.145  0.00  0.00    -0.147 OA
ATOM     16  O   LIG    1        1.573  -1.518  -2.611  0.00  0.00    -0.147 OA
BRANCH  14  17
ATOM     17  C   LIG    1        1.563   0.850  -1.603  0.00  0.00    +0.292 A 
ATOM     18  O   LIG    1        1.215   2.179  -1.609  0.00  0.00    -0.334 OA
ATOM     19  N   LIG    1        1.590   2.777  -0.419  0.00  0.00    -0.081 NA
ATOM     20  C   LIG    1        2.198   1.817   0.276  0.00  0.00    +0.089 A 
ATOM     21  C   LIG    1        2.208   0.593  -0.406  0.00  0.00    +0.097 A 
BRANCH  20  22
ATOM     22  C   LIG    1        2.781   2.036   1.694  0.00  0.00    +0.041 C 
ATOM     23  C   LIG    1        4.244   1.769   1.944  0.00  0.00    +0.010 C 
ATOM     24  C   LIG    1        3.734   3.180   1.929  0.00  0.00    +0.010 C 
ENDBRANCH  20  22
ENDBRANCH  14  17
ENDBRANCH  12  14
ENDBRANCH   8  12
BRANCH  10  25
ATOM     25  C   LIG    1       -3.173   0.351   2.450  0.00  0.00    +0.101 C 
ATOM     26  N   LIG    1       -3.655   0.281   3.504  0.00  0.00    -0.191 NA
ENDBRANCH  10  25
TORSDOF 5