REMARK  Name = BDB000750
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.553   0.497  -0.060  0.00  0.00    +0.065 C 
ATOM      2  C   LIG    1        5.189   0.198   0.436  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1        3.941   0.350  -0.144  0.00  0.00    +0.002 A 
ATOM      4  C   LIG    1        3.631   0.896  -1.496  0.00  0.00    +0.039 C 
ATOM      5  C   LIG    1        2.406   0.281  -2.174  0.00  0.00    +0.009 C 
ATOM      6  C   LIG    1        1.078   0.785  -1.606  0.00  0.00    +0.038 C 
ATOM      7  C   LIG    1        0.683   0.199  -0.287  0.00  0.00    -0.013 A 
ATOM      8  C   LIG    1       -0.665  -0.059   0.148  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1       -0.599  -0.594   1.444  0.00  0.00    +0.049 A 
ATOM     10  C   LIG    1       -1.727  -0.971   2.189  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -2.938  -0.776   1.553  0.00  0.00    +0.040 A 
ATOM     12  N   LIG    1       -4.194  -1.062   2.065  0.00  0.00    -0.284 N 
ATOM     13  H   LIG    1       -4.383  -1.453   2.975  0.00  0.00    +0.155 HD
ATOM     14  C   LIG    1       -5.199  -0.743   1.162  0.00  0.00    +0.227 C 
ATOM     15  O   LIG    1       -6.395  -0.892   1.355  0.00  0.00    -0.275 OA
ATOM     16  C   LIG    1       -4.521  -0.172  -0.107  0.00  0.00    +0.068 C 
ATOM     17  C   LIG    1       -4.977   1.268  -0.332  0.00  0.00    +0.025 C 
ATOM     18  C   LIG    1       -4.843  -1.062  -1.307  0.00  0.00    +0.025 C 
ATOM     19  C   LIG    1       -3.057  -0.247   0.272  0.00  0.00    -0.011 A 
ATOM     20  N   LIG    1        0.731  -0.651   1.778  0.00  0.00    -0.353 N 
ATOM     21  H   LIG    1        1.116  -0.988   2.651  0.00  0.00    +0.166 HD
ATOM     22  C   LIG    1       -1.932   0.122  -0.457  0.00  0.00    +0.016 A 
ATOM     23  C   LIG    1        1.503  -0.175   0.757  0.00  0.00    +0.071 A 
ATOM     24  C   LIG    1        3.045  -0.113   0.848  0.00  0.00    +0.112 A 
ATOM     25  N   LIG    1        3.670  -0.529   1.954  0.00  0.00    -0.172 NA
ATOM     26  N   LIG    1        4.966  -0.333   1.676  0.00  0.00    -0.281 N 
ATOM     27  H   LIG    1        5.651  -0.581   2.382  0.00  0.00    +0.189 HD
ENDROOT
TORSDOF 0