REMARK  Name = BDB065088
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.653   0.022   0.909  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        0.284   0.115   0.587  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1       -0.599   0.139   1.673  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -1.964   0.213   1.431  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1       -2.486   0.281   0.135  0.00  0.00    +0.164 A 
ATOM      6  C   LIG    1       -1.609   0.272  -0.960  0.00  0.00    +0.162 A 
ATOM      7  N   LIG    1       -0.182   0.093   2.941  0.00  0.00    -0.218 NA
ATOM      8  C   LIG    1        1.144   0.035   3.135  0.00  0.00    +0.234 A 
ATOM      9  C   LIG    1       -0.234   0.191  -0.730  0.00  0.00    +0.062 A 
ATOM     10  N   LIG    1        2.083  -0.005   2.179  0.00  0.00    -0.203 NA
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1        2.602  -0.033  -0.133  0.00  0.00    -0.326 N 
ATOM     12  H   LIG    1        2.365  -0.818  -0.736  0.00  0.00    +0.148 HD
BRANCH  11  16
ATOM     13  N   LIG    1        6.768   0.838  -0.290  0.00  0.00    -0.302 NA
ATOM     14  C   LIG    1        6.344  -0.530  -0.619  0.00  0.00    +0.086 C 
ATOM     15  C   LIG    1        4.848  -0.588  -0.926  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1        4.024  -0.053   0.250  0.00  0.00    +0.074 C 
ATOM     17  C   LIG    1        4.510   1.357   0.595  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1        6.013   1.360   0.861  0.00  0.00    +0.086 C 
BRANCH  13  19
ATOM     19  C   LIG    1        8.215   0.921  -0.020  0.00  0.00    +0.084 C 
BRANCH  19  21
ATOM     20  C   LIG    1        8.825   1.600  -2.403  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1        9.110   0.662  -1.240  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       -2.186   0.338  -2.202  0.00  0.00    -0.491 OA
ATOM     23  C   LIG    1       -1.330   0.507  -3.323  0.00  0.00    +0.277 C 
ENDBRANCH   6  22
BRANCH   8  24
ATOM     24  C   LIG    1        1.604  -0.002   4.499  0.00  0.00    +0.140 C 
ATOM     25  N   LIG    1        1.981  -0.035   5.599  0.00  0.00    -0.188 NA
ENDBRANCH   8  24
BRANCH   5  26
ATOM     26  O   LIG    1       -3.822   0.344  -0.167  0.00  0.00    -0.488 OA
BRANCH  26  27
ATOM     27  C   LIG    1       -4.776   0.580   0.869  0.00  0.00    +0.230 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -5.288  -0.734   1.462  0.00  0.00    +0.056 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -6.069  -1.586   0.453  0.00  0.00    +0.087 C 
BRANCH  29  30
ATOM     30  N   LIG    1       -7.316  -0.957   0.008  0.00  0.00    -0.302 NA
ATOM     31  C   LIG    1       -7.934  -1.695  -1.095  0.00  0.00    +0.084 C 
ATOM     32  C   LIG    1       -9.330  -1.097  -1.162  0.00  0.00    +0.017 C 
ATOM     33  C   LIG    1       -9.623  -0.621   0.256  0.00  0.00    +0.017 C 
ATOM     34  C   LIG    1       -8.349  -0.894   1.043  0.00  0.00    +0.084 C 
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH   5  26
TORSDOF 11