REMARK  Name = BDB001738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.449   1.274  -0.415  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -0.320   0.036  -0.038  0.00  0.00    -0.025 A 
ATOM      3  C   LIG    1        0.215  -1.254  -0.187  0.00  0.00    +0.055 A 
ATOM      4  C   LIG    1       -0.595  -2.311   0.209  0.00  0.00    +0.136 A 
ATOM      5  N   LIG    1       -1.847  -2.172   0.718  0.00  0.00    -0.238 NA
ATOM      6  C   LIG    1       -2.353  -0.932   0.847  0.00  0.00    +0.125 A 
ATOM      7  C   LIG    1       -1.619   0.185   0.489  0.00  0.00    +0.049 A 
ENDROOT
BRANCH   3   8
ATOM      8  N   LIG    1        1.516  -1.408  -0.718  0.00  0.00    -0.284 N 
ATOM      9  H   LIG    1        2.005  -0.556  -0.959  0.00  0.00    +0.155 HD
ATOM     10  C   LIG    1        2.226  -2.585  -0.878  0.00  0.00    +0.222 C 
ATOM     11  O   LIG    1        1.809  -3.707  -0.601  0.00  0.00    -0.275 OA
BRANCH  10  12
ATOM     12  C   LIG    1        3.602  -2.422  -1.517  0.00  0.00    +0.131 C 
BRANCH  12  13
ATOM     13  C   LIG    1        4.317  -1.127  -1.203  0.00  0.00    -0.039 A 
ATOM     14  C   LIG    1        4.503  -0.158  -2.199  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        5.133   1.050  -1.897  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        5.583   1.299  -0.602  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        5.405   0.340   0.394  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.777  -0.870   0.096  0.00  0.00    +0.004 A 
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   3   8
BRANCH   6  19
ATOM     19  N   LIG    1       -3.636  -0.948   1.385  0.00  0.00    -0.270 N 
ATOM     20  H   LIG    1       -3.901  -1.892   1.643  0.00  0.00    +0.156 HD
ATOM     21  C   LIG    1       -4.609  -0.051   1.683  0.00  0.00    +0.221 C 
ATOM     22  O   LIG    1       -5.609  -0.489   2.264  0.00  0.00    -0.275 OA
BRANCH  21  23
ATOM     23  C   LIG    1       -4.529   1.418   1.292  0.00  0.00    +0.069 C 
ATOM     24  C   LIG    1       -5.606   2.233   2.017  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1       -4.709   1.578  -0.216  0.00  0.00    +0.017 C 
ENDBRANCH  21  23
ENDBRANCH   6  19
TORSDOF 5