REMARK  Name = BDB060333
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.329  -2.334  -1.358  0.00  0.00    +0.080 C 
ATOM      2  C   LIG    1        1.094  -3.400  -0.551  0.00  0.00    +0.028 C 
ATOM      3  C   LIG    1        2.532  -2.886  -0.471  0.00  0.00    +0.039 C 
ATOM      4  C   LIG    1        2.351  -1.399  -0.590  0.00  0.00    -0.026 C 
ATOM      5  C   LIG    1        1.138  -1.103  -1.081  0.00  0.00    -0.003 C 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        3.389  -0.462  -0.234  0.00  0.00    +0.047 A 
ATOM      7  N   LIG    1        4.678  -0.780  -0.586  0.00  0.00    -0.322 N 
ATOM      8  H   LIG    1        4.866  -1.632  -1.101  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1        5.784  -0.004  -0.318  0.00  0.00    +0.258 A 
ATOM     10  O   LIG    1        6.912  -0.336  -0.664  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1        5.540   1.255   0.410  0.00  0.00    +0.065 A 
ATOM     12  C   LIG    1        4.237   1.576   0.769  0.00  0.00    +0.078 A 
ATOM     13  N   LIG    1        3.909   2.709   1.437  0.00  0.00    -0.255 NA
ATOM     14  C   LIG    1        4.927   3.543   1.752  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        6.257   3.301   1.433  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        6.570   2.131   0.746  0.00  0.00    +0.017 A 
ATOM     17  C   LIG    1        3.138   0.677   0.432  0.00  0.00    +0.054 A 
ENDBRANCH   4   6
BRANCH   1  21
ATOM     18  N   LIG    1       -3.209  -0.300  -0.245  0.00  0.00    -0.327 N 
ATOM     19  C   LIG    1       -2.392  -0.080  -1.448  0.00  0.00    +0.120 C 
ATOM     20  C   LIG    1       -1.850  -1.413  -2.019  0.00  0.00    +0.104 C 
ATOM     21  N   LIG    1       -1.103  -2.270  -1.074  0.00  0.00    -0.293 NA
ATOM     22  C   LIG    1       -1.466  -1.985   0.327  0.00  0.00    +0.104 C 
ATOM     23  C   LIG    1       -2.934  -1.530   0.516  0.00  0.00    +0.120 C 
BRANCH  18  27
ATOM     24  C   LIG    1       -6.257   2.404   0.899  0.00  0.00    +0.052 A 
ATOM     25  C   LIG    1       -5.232   2.814   0.050  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1       -4.226   1.912  -0.326  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1       -4.207   0.583   0.129  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1       -5.253   0.201   0.985  0.00  0.00    +0.024 A 
ATOM     29  C   LIG    1       -6.266   1.092   1.367  0.00  0.00    +0.020 A 
BRANCH  24  31
ATOM     30  N   LIG    1       -8.125   4.062   1.599  0.00  0.00    -0.191 NA
ATOM     31  C   LIG    1       -7.289   3.320   1.286  0.00  0.00    +0.099 C 
ENDBRANCH  24  31
ENDBRANCH  18  27
ENDBRANCH   1  21
TORSDOF 4