REMARK  Name = BDB060770
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.233  -1.032  -0.029  0.00  0.00    -0.284 N 
ATOM      2  H   LIG    1        1.338  -0.030   0.039  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   1   5
ATOM      3  C   LIG    1       -2.398  -0.980  -0.900  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -1.086  -0.602  -0.551  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1       -0.031  -1.523  -0.375  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1       -0.317  -2.875  -0.544  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1       -1.603  -3.292  -0.881  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -2.624  -2.354  -1.054  0.00  0.00    +0.023 A 
BRANCH   3  14
ATOM      9  C   LIG    1       -5.120   1.714   2.531  0.00  0.00    +0.109 C 
ATOM     10  C   LIG    1       -5.964   0.990   1.513  0.00  0.00    +0.213 C 
ATOM     11  N   LIG    1       -5.760   1.303   0.174  0.00  0.00    -0.300 N 
ATOM     12  C   LIG    1       -4.618   2.077  -0.328  0.00  0.00    +0.126 C 
ATOM     13  C   LIG    1       -3.300   1.287  -0.461  0.00  0.00    +0.124 C 
ATOM     14  N   LIG    1       -3.425  -0.049  -1.064  0.00  0.00    -0.328 N 
ATOM     15  C   LIG    1       -4.478  -0.297  -2.052  0.00  0.00    +0.106 C 
ATOM     16  C   LIG    1       -5.793  -0.659  -1.363  0.00  0.00    +0.038 C 
ATOM     17  C   LIG    1       -6.525   0.567  -0.828  0.00  0.00    +0.109 C 
ATOM     18  O   LIG    1       -6.814   0.180   1.886  0.00  0.00    -0.276 OA
ENDBRANCH   3  14
ENDBRANCH   1   5
BRANCH   1  19
ATOM     19  C   LIG    1        2.477  -1.613   0.192  0.00  0.00    +0.220 A 
ATOM     20  N   LIG    1        3.451  -0.743   0.493  0.00  0.00    -0.214 NA
ATOM     21  C   LIG    1        4.687  -1.237   0.704  0.00  0.00    +0.080 A 
ATOM     22  C   LIG    1        4.979  -2.580   0.638  0.00  0.00    +0.048 A 
ATOM     23  C   LIG    1        3.920  -3.393   0.332  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1        2.675  -2.937   0.111  0.00  0.00    -0.223 NA
BRANCH  21  25
ATOM     25  C   LIG    1        5.713  -0.265   1.035  0.00  0.00    +0.044 A 
ATOM     26  C   LIG    1        6.058   0.949   0.376  0.00  0.00    +0.098 A 
ATOM     27  C   LIG    1        7.098   1.539   1.094  0.00  0.00    +0.066 A 
ATOM     28  C   LIG    1        7.667   2.749   0.697  0.00  0.00    +0.029 A 
ATOM     29  C   LIG    1        7.136   3.321  -0.456  0.00  0.00    +0.022 A 
ATOM     30  C   LIG    1        6.106   2.672  -1.122  0.00  0.00    +0.111 A 
ATOM     31  N   LIG    1        7.374   0.715   2.158  0.00  0.00    -0.359 N 
ATOM     32  H   LIG    1        8.079   0.897   2.859  0.00  0.00    +0.165 HD
ATOM     33  N   LIG    1        5.547   1.502  -0.754  0.00  0.00    -0.253 NA
ATOM     34  C   LIG    1        6.551  -0.383   2.131  0.00  0.00    +0.095 A 
ENDBRANCH  21  25
ENDBRANCH   1  19
TORSDOF 4