REMARK  Name = BDB014486
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.384  -1.685   0.993  0.00  0.00    +0.251 C 
ATOM      2  N   LIG    1        0.285  -1.317   0.231  0.00  0.00    -0.310 N 
ATOM      3  H   LIG    1        0.382  -0.506  -0.368  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        1.501  -2.799   1.491  0.00  0.00    -0.272 OA
ENDROOT
BRANCH   1   5
ATOM      5  C   LIG    1        2.416  -0.560   1.161  0.00  0.00    +0.324 C 
BRANCH   5   6
ATOM      6  O   LIG    1        3.656  -0.955   1.744  0.00  0.00    -0.481 OA
BRANCH   6  16
ATOM      7  C   LIG    1        5.120   1.345   2.224  0.00  0.00    +0.138 C 
ATOM      8  N   LIG    1        5.684   1.029   0.925  0.00  0.00    -0.266 N 
ATOM      9  C   LIG    1        5.525  -0.266   0.339  0.00  0.00    +0.120 A 
ATOM     10  C   LIG    1        6.377  -0.631  -0.719  0.00  0.00    +0.146 A 
ATOM     11  C   LIG    1        6.359  -1.921  -1.259  0.00  0.00    +0.048 A 
ATOM     12  C   LIG    1        5.469  -2.872  -0.772  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1        4.586  -2.524   0.245  0.00  0.00    +0.048 A 
ATOM     14  O   LIG    1        7.322   0.202  -1.257  0.00  0.00    -0.481 OA
ATOM     15  C   LIG    1        7.019   1.569  -1.061  0.00  0.00    +0.325 C 
ATOM     16  C   LIG    1        4.591  -1.227   0.775  0.00  0.00    +0.146 A 
ATOM     17  C   LIG    1        6.483   1.980   0.302  0.00  0.00    +0.257 C 
ATOM     18  O   LIG    1        6.693   3.107   0.753  0.00  0.00    -0.272 OA
ENDBRANCH   6  16
ENDBRANCH   5   6
ENDBRANCH   1   5
BRANCH   2  19
ATOM     19  C   LIG    1       -0.730  -2.300  -0.112  0.00  0.00    +0.136 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.070  -1.670  -0.532  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.871  -2.674  -1.166  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -2.412  -2.960  -1.974  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -2.813  -1.095   0.703  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.007  -0.257   0.482  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -3.705   1.022  -0.174  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -4.933   1.876  -0.420  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.218   1.304  -0.436  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.335   2.108  -0.697  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -7.177   3.467  -0.966  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.905   4.034  -0.970  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.395  -0.158  -0.105  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -4.787   3.243  -0.701  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -5.087  -0.953  -0.227  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 8