REMARK  Name = BDB065233
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.196  -0.152   1.106  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1       -3.409  -1.303   1.268  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1       -2.057  -1.254   0.923  0.00  0.00    +0.062 A 
ATOM      4  C   LIG    1       -1.472  -0.067   0.414  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1       -2.272   1.068   0.236  0.00  0.00    +0.081 A 
ATOM      6  N   LIG    1       -1.799   2.212  -0.262  0.00  0.00    -0.218 NA
ATOM      7  C   LIG    1       -0.502   2.226  -0.602  0.00  0.00    +0.234 A 
ATOM      8  N   LIG    1        0.362   1.209  -0.466  0.00  0.00    -0.203 NA
ATOM      9  C   LIG    1       -0.116   0.070   0.050  0.00  0.00    +0.131 A 
ATOM     10  C   LIG    1       -3.615   1.010   0.588  0.00  0.00    +0.078 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -6.346   0.875   1.313  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -5.514  -0.266   1.471  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   2  13
ATOM     13  O   LIG    1       -4.045  -2.408   1.771  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1       -3.317  -3.627   1.823  0.00  0.00    +0.277 C 
ENDBRANCH   2  13
BRANCH   7  15
ATOM     15  C   LIG    1        0.018   3.455  -1.141  0.00  0.00    +0.140 C 
ATOM     16  N   LIG    1        0.438   4.453  -1.568  0.00  0.00    -0.188 NA
ENDBRANCH   7  15
BRANCH   9  17
ATOM     17  N   LIG    1        0.752  -1.018   0.224  0.00  0.00    -0.326 N 
ATOM     18  H   LIG    1        0.710  -1.319   1.195  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        2.145  -0.974  -0.253  0.00  0.00    +0.074 C 
ATOM     20  C   LIG    1        3.023   0.067   0.454  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1        3.684   1.024  -0.538  0.00  0.00    +0.086 C 
ATOM     22  N   LIG    1        4.395   0.361  -1.635  0.00  0.00    -0.305 NA
ATOM     23  C   LIG    1        5.798   0.106  -1.327  0.00  0.00    +0.104 C 
ATOM     24  C   LIG    1        3.730  -0.836  -2.163  0.00  0.00    +0.086 C 
ATOM     25  C   LIG    1        2.254  -0.932  -1.779  0.00  0.00    +0.037 C 
ENDBRANCH  17  19
ENDBRANCH   9  17
TORSDOF 5