REMARK  Name = BDB065087
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.320  -1.652   0.567  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1       -1.375  -0.739   0.411  0.00  0.00    +0.164 A 
ATOM      3  C   LIG    1       -1.088   0.620   0.246  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        0.215   1.098   0.202  0.00  0.00    +0.081 A 
ATOM      5  C   LIG    1        1.276   0.192   0.321  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        2.570   0.748   0.247  0.00  0.00    +0.131 A 
ATOM      7  N   LIG    1        2.767   2.069   0.121  0.00  0.00    -0.203 NA
ATOM      8  C   LIG    1        1.673   2.837   0.028  0.00  0.00    +0.234 A 
ATOM      9  N   LIG    1        0.401   2.411   0.051  0.00  0.00    -0.218 NA
ATOM     10  C   LIG    1        0.994  -1.185   0.517  0.00  0.00    +0.062 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        0.359  -3.899   1.020  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -0.674  -2.963   0.749  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   8  13
ATOM     13  C   LIG    1        1.885   4.253  -0.119  0.00  0.00    +0.140 C 
ATOM     14  N   LIG    1        2.060   5.398  -0.241  0.00  0.00    -0.188 NA
ENDBRANCH   8  13
BRANCH   6  15
ATOM     15  N   LIG    1        3.692  -0.098   0.348  0.00  0.00    -0.326 N 
ATOM     16  H   LIG    1        3.603  -0.858  -0.323  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1        5.024   0.527   0.276  0.00  0.00    +0.074 C 
ATOM     18  C   LIG    1        5.383   0.887  -1.174  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1        6.880   0.737  -1.423  0.00  0.00    +0.086 C 
ATOM     20  N   LIG    1        7.311  -0.658  -1.263  0.00  0.00    -0.305 NA
ATOM     21  C   LIG    1        8.768  -0.743  -1.189  0.00  0.00    +0.104 C 
ATOM     22  C   LIG    1        6.659  -1.363  -0.151  0.00  0.00    +0.086 C 
ATOM     23  C   LIG    1        6.051  -0.435   0.897  0.00  0.00    +0.037 C 
ENDBRANCH  15  17
ENDBRANCH   6  15
BRANCH   2  24
ATOM     24  O   LIG    1       -2.641  -1.261   0.478  0.00  0.00    -0.488 OA
BRANCH  24  25
ATOM     25  C   LIG    1       -3.737  -0.491  -0.021  0.00  0.00    +0.230 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.432   0.234   1.130  0.00  0.00    +0.056 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -5.546   1.172   0.659  0.00  0.00    +0.087 C 
BRANCH  27  28
ATOM     28  N   LIG    1       -6.587   0.501  -0.121  0.00  0.00    -0.302 NA
ATOM     29  C   LIG    1       -7.383  -0.450   0.659  0.00  0.00    +0.084 C 
ATOM     30  C   LIG    1       -8.611  -0.679  -0.211  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1       -8.700   0.547  -1.112  0.00  0.00    +0.017 C 
ATOM     32  C   LIG    1       -7.564   1.450  -0.661  0.00  0.00    +0.084 C 
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   2  24
TORSDOF 9