REMARK  Name = BDB036957
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        4.115   1.085   1.312  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        3.158   0.673   0.659  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1        2.692   1.382  -0.418  0.00  0.00    -0.255 N 
ATOM      4  H   LIG    1        3.125   2.284  -0.553  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1        1.540   1.167  -1.133  0.00  0.00    +0.240 C 
ATOM      6  O   LIG    1        1.098   2.036  -1.886  0.00  0.00    -0.273 OA
ATOM      7  C   LIG    1        0.834  -0.180  -0.923  0.00  0.00    +0.163 C 
ATOM      8  C   LIG    1        1.683  -1.194  -0.156  0.00  0.00    +0.041 C 
ATOM      9  C   LIG    1        2.430  -0.598   1.023  0.00  0.00    +0.098 C 
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1       -0.547  -0.021  -0.443  0.00  0.00    -0.288 N 
ATOM     11  C   LIG    1       -0.797   0.647   0.753  0.00  0.00    +0.230 C 
ATOM     12  O   LIG    1        0.094   1.242   1.362  0.00  0.00    -0.274 OA
ATOM     13  C   LIG    1       -2.253   0.742   1.237  0.00  0.00    +0.177 C 
ATOM     14  N   LIG    1       -3.111  -0.375   0.799  0.00  0.00    -0.307 NA
ATOM     15  H   LIG    1       -4.076  -0.153   1.041  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -2.991  -0.533  -0.648  0.00  0.00    +0.100 C 
ATOM     17  C   LIG    1       -1.554  -0.923  -1.000  0.00  0.00    +0.123 C 
ENDBRANCH   7  10
TORSDOF 1