REMARK  Name = BDB014673
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.908  -0.921  -2.352  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1        0.206  -1.043  -1.847  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1        0.659  -0.257  -0.811  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1        1.667  -0.274  -0.637  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -0.068   0.925  -0.358  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1       -0.804   0.692   0.974  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1        0.081   0.036   1.895  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1        0.480  -0.700   1.394  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1       -2.102  -0.131   0.830  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1       -3.164   0.597   0.113  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1       -3.927   1.500   0.995  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1       -4.961   0.825   1.874  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1       -5.465  -0.449   1.553  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1       -6.442  -1.037   2.367  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -6.936  -0.356   3.478  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -6.454   0.914   3.788  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -4.909  -1.208   0.374  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1       -5.474   1.503   2.989  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -4.096  -0.314  -0.572  0.00  0.00    +0.089 C 
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   5   6
ENDBRANCH   3   5
BRANCH   2  20
ATOM     20  C   LIG    1        1.161  -2.162  -2.291  0.00  0.00    +0.324 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.536  -2.046  -1.945  0.00  0.00    -0.481 OA
BRANCH  21  22
ATOM     22  C   LIG    1        3.203  -1.075  -2.659  0.00  0.00    +0.142 A 
ATOM     23  C   LIG    1        3.784   0.005  -1.946  0.00  0.00    +0.072 A 
ATOM     24  C   LIG    1        4.395   1.008  -2.716  0.00  0.00    +0.027 A 
ATOM     25  C   LIG    1        4.483   0.915  -4.110  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1        3.957  -0.187  -4.775  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        3.319  -1.187  -4.050  0.00  0.00    +0.047 A 
BRANCH  23  28
ATOM     28  N   LIG    1        3.697   0.080  -0.544  0.00  0.00    -0.325 N 
ATOM     29  C   LIG    1        3.973   1.358   0.141  0.00  0.00    +0.120 C 
ATOM     30  C   LIG    1        3.753   1.209   1.664  0.00  0.00    +0.100 C 
ATOM     31  N   LIG    1        4.601   0.195   2.318  0.00  0.00    -0.313 NA
ATOM     32  H   LIG    1        5.383   0.648   2.788  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1        5.128  -0.777   1.345  0.00  0.00    +0.100 C 
ATOM     34  C   LIG    1        4.163  -1.132   0.190  0.00  0.00    +0.120 C 
ENDBRANCH  23  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9