REMARK  Name = BDB014573
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.101   1.913  -1.895  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1        0.227   2.764   0.518  0.00  0.00    -0.273 OA
ATOM      3  C   LIG    1        0.728   1.894  -0.188  0.00  0.00    +0.239 C 
ATOM      4  N   LIG    1        0.099   1.355  -1.287  0.00  0.00    -0.311 N 
ATOM      5  H   LIG    1        0.703   0.770  -1.861  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1        2.103   1.285   0.102  0.00  0.00    +0.255 C 
BRANCH   6   7
ATOM      7  O   LIG    1        2.511   0.401  -0.945  0.00  0.00    -0.369 OA
BRANCH   7   8
ATOM      8  C   LIG    1        3.799  -0.180  -0.708  0.00  0.00    +0.176 C 
BRANCH   8   9
ATOM      9  C   LIG    1        4.934   0.768  -1.144  0.00  0.00    +0.112 C 
BRANCH   9  10
ATOM     10  N   LIG    1        6.301   0.244  -1.110  0.00  0.00    -0.296 NA
ATOM     11  C   LIG    1        6.551  -0.894  -2.012  0.00  0.00    +0.112 C 
ATOM     12  C   LIG    1        6.791  -2.221  -1.274  0.00  0.00    +0.175 C 
ATOM     13  O   LIG    1        7.872  -2.166  -0.334  0.00  0.00    -0.377 OA
ATOM     14  C   LIG    1        8.092  -0.854   0.205  0.00  0.00    +0.175 C 
ATOM     15  C   LIG    1        6.811  -0.008   0.248  0.00  0.00    +0.112 C 
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1       -2.372   1.923  -1.015  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -2.327   3.031  -0.105  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1       -1.442   3.022   0.320  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1       -2.582   0.588  -0.260  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -3.989   0.276   0.087  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1       -4.054  -1.071   0.693  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1       -5.423  -1.448   1.217  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1       -6.372  -0.461   1.526  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1       -7.620  -0.831   2.044  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -7.917  -2.173   2.277  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -6.971  -3.155   1.988  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -6.070   0.985   1.234  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1       -5.729  -2.795   1.464  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -4.574   1.258   1.015  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 10