REMARK  Name = BDB014474
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.311  -2.442  -2.191  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -1.694  -2.017  -1.104  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1       -0.857  -1.425  -0.175  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1       -1.269  -0.976   0.631  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        0.528  -1.093  -0.493  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1        0.720   0.420  -0.714  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1       -0.099   0.858  -1.807  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1       -0.089   1.829  -1.815  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1        2.192   0.765  -1.031  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1        3.151   0.418   0.031  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1        4.525   0.432  -0.516  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1        5.603   0.235   0.529  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1        5.345   0.476   1.889  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1        6.369   0.313   2.833  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        7.649  -0.063   2.425  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        7.914  -0.283   1.075  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        3.953   0.840   2.334  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        6.898  -0.132   0.131  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        3.075   1.340   1.176  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       -3.155  -2.120  -0.647  0.00  0.00    +0.324 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -4.108  -1.755  -1.645  0.00  0.00    -0.482 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -4.262  -0.390  -1.688  0.00  0.00    +0.130 A 
ATOM     23  C   LIG    1       -5.178   0.285  -0.865  0.00  0.00    +0.044 A 
ATOM     24  C   LIG    1       -5.250   1.686  -0.959  0.00  0.00    +0.014 A 
ATOM     25  C   LIG    1       -4.460   2.386  -1.876  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -3.588   1.695  -2.714  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -3.491   0.308  -2.623  0.00  0.00    +0.046 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -6.065  -0.415   0.067  0.00  0.00    +0.096 A 
ATOM     29  N   LIG    1       -6.387   0.110   1.264  0.00  0.00    -0.174 NA
ATOM     30  N   LIG    1       -7.213  -0.792   1.817  0.00  0.00    -0.284 N 
ATOM     31  H   LIG    1       -7.589  -0.596   2.738  0.00  0.00    +0.188 HD
ATOM     32  C   LIG    1       -7.444  -1.877   1.029  0.00  0.00    +0.105 A 
ATOM     33  C   LIG    1       -6.714  -1.667  -0.115  0.00  0.00    +0.049 A 
ENDBRANCH  23  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9