REMARK  Name = BDB014088
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.600   1.498   2.877  0.00  0.00    +0.172 C 
ATOM      2  N   LIG    1       -3.238   0.900   1.615  0.00  0.00    -0.272 N 
ATOM      3  N   LIG    1       -2.417   1.560   0.787  0.00  0.00    -0.165 NA
ATOM      4  C   LIG    1       -2.309   0.758  -0.297  0.00  0.00    +0.168 A 
ATOM      5  C   LIG    1       -1.670   1.235  -1.537  0.00  0.00    +0.266 C 
ATOM      6  N   LIG    1       -0.555   2.042  -1.470  0.00  0.00    -0.307 N 
ATOM      7  H   LIG    1       -0.254   2.370  -2.378  0.00  0.00    +0.149 HD
ATOM      8  C   LIG    1        0.209   2.396  -0.288  0.00  0.00    +0.145 C 
ATOM      9  C   LIG    1        1.680   2.674  -0.614  0.00  0.00    +0.249 C 
ATOM     10  O   LIG    1        2.515   2.578   0.557  0.00  0.00    -0.474 OA
ATOM     11  C   LIG    1        2.789   1.321   0.986  0.00  0.00    +0.233 A 
ATOM     12  N   LIG    1        2.308   0.266   0.426  0.00  0.00    -0.130 NA
ATOM     13  N   LIG    1        2.640  -0.950   0.981  0.00  0.00    -0.222 N 
ATOM     14  C   LIG    1        2.058  -2.160   0.405  0.00  0.00    +0.182 C 
ATOM     15  C   LIG    1        1.198  -1.963  -0.826  0.00  0.00    -0.025 A 
ATOM     16  C   LIG    1       -0.202  -2.043  -0.747  0.00  0.00    +0.018 A 
ATOM     17  C   LIG    1       -0.986  -1.898  -1.901  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1       -2.453  -2.119  -1.860  0.00  0.00    +0.248 C 
ATOM     19  N   LIG    1       -3.213  -1.610  -0.835  0.00  0.00    -0.278 N 
ATOM     20  H   LIG    1       -4.086  -2.106  -0.698  0.00  0.00    +0.155 HD
ATOM     21  O   LIG    1       -2.954  -2.898  -2.671  0.00  0.00    -0.270 OA
ATOM     22  C   LIG    1       -0.374  -1.685  -3.140  0.00  0.00    +0.013 A 
ATOM     23  C   LIG    1        1.013  -1.573  -3.222  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        1.794  -1.712  -2.072  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1        3.454  -1.080   2.102  0.00  0.00    +0.268 A 
ATOM     26  O   LIG    1        3.749  -2.147   2.633  0.00  0.00    -0.266 OA
ATOM     27  C   LIG    1        3.986   0.181   2.674  0.00  0.00    +0.077 A 
ATOM     28  C   LIG    1        3.671   1.366   2.147  0.00  0.00    +0.074 A 
ATOM     29  O   LIG    1       -2.115   0.959  -2.652  0.00  0.00    -0.268 OA
ATOM     30  C   LIG    1       -3.027  -0.464  -0.084  0.00  0.00    +0.084 A 
ATOM     31  C   LIG    1       -3.657  -0.298   1.129  0.00  0.00    +0.132 A 
ENDROOT
TORSDOF 0