REMARK  Name = BDB065099
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.777   0.032  -0.633  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        0.367   0.015  -0.878  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1       -0.390   1.151  -0.513  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1       -1.755   1.179  -0.763  0.00  0.00    +0.077 A 
ATOM      5  C   LIG    1       -2.423   0.102  -1.352  0.00  0.00    +0.164 A 
ATOM      6  C   LIG    1       -1.699  -1.047  -1.694  0.00  0.00    +0.162 A 
ATOM      7  N   LIG    1        0.146   2.224   0.079  0.00  0.00    -0.236 NA
ATOM      8  C   LIG    1        1.465   2.196   0.357  0.00  0.00    +0.142 A 
ATOM      9  C   LIG    1       -0.322  -1.082  -1.456  0.00  0.00    +0.061 A 
ATOM     10  C   LIG    1        2.298   1.137   0.034  0.00  0.00    +0.062 A 
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1        2.551  -1.077  -0.983  0.00  0.00    -0.340 N 
ATOM     12  H   LIG    1        2.239  -1.476  -1.866  0.00  0.00    +0.146 HD
BRANCH  11  16
ATOM     13  N   LIG    1        6.730  -0.679   0.049  0.00  0.00    -0.302 NA
ATOM     14  C   LIG    1        6.345  -0.638  -1.370  0.00  0.00    +0.086 C 
ATOM     15  C   LIG    1        4.863  -0.335  -1.602  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1        3.992  -1.297  -0.795  0.00  0.00    +0.073 C 
ATOM     17  C   LIG    1        4.403  -1.407   0.673  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1        5.909  -1.654   0.782  0.00  0.00    +0.086 C 
BRANCH  13  19
ATOM     19  C   LIG    1        6.765   0.664   0.648  0.00  0.00    +0.084 C 
BRANCH  19  21
ATOM     20  C   LIG    1        7.615   2.124   2.521  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1        7.470   0.698   2.010  0.00  0.00    +0.012 C 
ENDBRANCH  19  21
ENDBRANCH  13  19
ENDBRANCH  11  16
ENDBRANCH   1  11
BRANCH   6  22
ATOM     22  O   LIG    1       -2.418  -2.070  -2.260  0.00  0.00    -0.491 OA
ATOM     23  C   LIG    1       -1.763  -3.317  -2.443  0.00  0.00    +0.277 C 
ENDBRANCH   6  22
BRANCH   8  24
ATOM     24  C   LIG    1        1.992   3.357   1.020  0.00  0.00    +0.119 C 
ATOM     25  N   LIG    1        2.466   4.274   1.553  0.00  0.00    -0.189 NA
ENDBRANCH   8  24
BRANCH   5  26
ATOM     26  O   LIG    1       -3.766   0.075  -1.625  0.00  0.00    -0.488 OA
BRANCH  26  27
ATOM     27  C   LIG    1       -4.557   1.192  -1.218  0.00  0.00    +0.230 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -6.017   0.908  -1.570  0.00  0.00    +0.056 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -6.619  -0.242  -0.754  0.00  0.00    +0.087 C 
BRANCH  29  30
ATOM     30  N   LIG    1       -6.690   0.045   0.682  0.00  0.00    -0.302 NA
ATOM     31  C   LIG    1       -7.677   1.069   1.031  0.00  0.00    +0.084 C 
ATOM     32  C   LIG    1       -7.868   0.881   2.530  0.00  0.00    +0.017 C 
ATOM     33  C   LIG    1       -7.429  -0.551   2.814  0.00  0.00    +0.017 C 
ATOM     34  C   LIG    1       -7.087  -1.135   1.454  0.00  0.00    +0.084 C 
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH   5  26
TORSDOF 11