REMARK  Name = BDB020194
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.022  -0.103   0.717  0.00  0.00    +0.229 C 
ATOM      2  N   LIG    1        0.971   0.286  -0.162  0.00  0.00    -0.284 N 
ATOM      3  H   LIG    1        0.667   0.584  -1.090  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.176  -0.652   1.798  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -5.259  -0.447  -1.144  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -4.130  -0.313  -0.681  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -3.022  -0.383  -1.487  0.00  0.00    -0.256 N 
ATOM      8  H   LIG    1       -3.214  -0.537  -2.468  0.00  0.00    +0.157 HD
ATOM      9  C   LIG    1       -1.740  -0.009  -1.173  0.00  0.00    +0.231 C 
ATOM     10  O   LIG    1       -0.907   0.159  -2.064  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1       -1.437   0.289   0.283  0.00  0.00    +0.162 C 
ATOM     12  C   LIG    1       -2.480  -0.377   1.188  0.00  0.00    +0.031 C 
ATOM     13  C   LIG    1       -3.883   0.026   0.766  0.00  0.00    +0.097 C 
ENDBRANCH   1  11
BRANCH   2  14
ATOM     14  C   LIG    1        2.364   0.151   0.014  0.00  0.00    +0.052 A 
ATOM     15  C   LIG    1        2.991  -0.278   1.180  0.00  0.00    +0.134 A 
ATOM     16  N   LIG    1        4.338  -0.387   1.325  0.00  0.00    -0.261 NA
ATOM     17  C   LIG    1        5.095  -0.056   0.259  0.00  0.00    +0.111 A 
ATOM     18  C   LIG    1        4.571   0.383  -0.944  0.00  0.00    +0.021 A 
ATOM     19  C   LIG    1        3.187   0.488  -1.064  0.00  0.00    +0.026 A 
ENDBRANCH   2  14
TORSDOF 2