REMARK  Name = BDB057195
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.579  -2.269   0.356  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1        1.905  -1.000   0.137  0.00  0.00    -0.316 N 
ATOM      3  C   LIG    1        2.667   0.148  -0.064  0.00  0.00    +0.272 A 
ATOM      4  O   LIG    1        3.898   0.174  -0.101  0.00  0.00    -0.266 OA
ATOM      5  C   LIG    1        1.895   1.445  -0.276  0.00  0.00    +0.091 A 
ATOM      6  C   LIG    1        0.556   1.385  -0.314  0.00  0.00    +0.038 A 
ATOM      7  C   LIG    1       -0.171   0.144  -0.129  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1        0.521  -0.986   0.094  0.00  0.00    +0.097 A 
ENDROOT
BRANCH   7   9
ATOM      9  C   LIG    1       -1.641   0.073  -0.155  0.00  0.00    -0.014 A 
ATOM     10  C   LIG    1       -2.387   0.574   0.914  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1       -3.767   0.492   0.845  0.00  0.00    +0.111 A 
ATOM     12  N   LIG    1       -4.437  -0.041  -0.199  0.00  0.00    -0.263 NA
ATOM     13  C   LIG    1       -3.694  -0.512  -1.223  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1       -2.310  -0.478  -1.249  0.00  0.00    +0.028 A 
ENDBRANCH   7   9
BRANCH   5  15
ATOM     15  N   LIG    1        2.636   2.606  -0.440  0.00  0.00    -0.354 N 
ATOM     16  H   LIG    1        3.609   2.369  -0.655  0.00  0.00    +0.142 HD
ATOM     17  H   LIG    1        2.232   3.245  -1.117  0.00  0.00    +0.142 HD
ENDBRANCH   5  15
TORSDOF 2