REMARK  Name = BDB026704
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.381  -0.915   0.086  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.451  -1.341   1.044  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.141  -0.841   0.983  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        1.082  -1.142   1.789  0.00  0.00    -0.227 NA
ATOM      5  C   LIG    1        0.064  -0.436   1.334  0.00  0.00    +0.148 A 
ATOM      6  N   LIG    1        0.439   0.348   0.239  0.00  0.00    -0.292 N 
ATOM      7  C   LIG    1        1.788   0.086   0.007  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        2.704   0.511  -0.969  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        4.008   0.004  -0.900  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -0.376   1.270  -0.480  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -1.703   0.949  -0.795  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -2.503   1.866  -1.490  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -3.954   1.577  -1.762  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -4.434   2.294  -3.013  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -4.017   3.746  -3.031  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -2.776   4.031  -2.526  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -2.453   4.979  -2.671  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -4.702   4.622  -3.554  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -1.973   3.106  -1.855  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -0.659   3.438  -1.532  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1        0.144   2.517  -0.854  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -1.228  -0.407   2.016  0.00  0.00    +0.047 A 
ATOM     23  C   LIG    1       -2.110  -1.489   2.015  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1       -3.276  -1.521   2.721  0.00  0.00    -0.251 NA
ATOM     25  C   LIG    1       -3.575  -0.428   3.455  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1       -2.771   0.697   3.518  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1       -1.580   0.702   2.796  0.00  0.00    +0.015 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -1.879  -2.682   1.154  0.00  0.00    +0.179 C 
ATOM     29  O   LIG    1       -1.408  -2.563   0.024  0.00  0.00    -0.291 OA
ATOM     30  C   LIG    1       -2.320  -4.015   1.697  0.00  0.00    +0.093 C 
ENDBRANCH  23  28
ENDBRANCH   5  22
BRANCH   1  34
ATOM     31  C   LIG    1        7.290  -3.286   0.554  0.00  0.00    +0.128 C 
ATOM     32  N   LIG    1        5.988  -2.671   0.614  0.00  0.00    -0.314 N 
ATOM     33  H   LIG    1        5.189  -3.278   0.743  0.00  0.00    +0.149 HD
ATOM     34  C   LIG    1        5.785  -1.410   0.093  0.00  0.00    +0.244 C 
ATOM     35  O   LIG    1        6.681  -0.718  -0.378  0.00  0.00    -0.270 OA
ENDBRANCH   1  34
TORSDOF 4