REMARK  Name = BDB005595
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.504   0.965   0.740  0.00  0.00    -0.031 A 
ATOM      2  C   LIG    1       -0.191   1.372  -0.405  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1       -1.549   1.069  -0.547  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1       -2.246   0.344   0.432  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1       -3.681   0.041   0.206  0.00  0.00    +0.045 A 
ATOM      6  N   LIG    1       -4.366  -0.755   1.122  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1       -3.767  -1.428   1.593  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1       -5.683  -1.294   0.801  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1       -6.504  -0.231   0.082  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -5.759   0.287  -1.153  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -4.297   0.532  -0.888  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1       -3.555   1.319  -1.908  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1       -4.104   1.758  -2.915  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1       -1.548  -0.039   1.585  0.00  0.00    +0.012 A 
ATOM     15  N   LIG    1       -2.223   1.520  -1.686  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1       -1.738   2.056  -2.392  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1       -0.189   0.264   1.735  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   1  18
ATOM     18  C   LIG    1        1.973   1.292   0.914  0.00  0.00    +0.119 C 
BRANCH  18  23
ATOM     19  C   LIG    1        6.484  -1.501  -0.257  0.00  0.00    +0.105 C 
ATOM     20  N   LIG    1        5.287  -0.724  -0.565  0.00  0.00    -0.303 NA
ATOM     21  C   LIG    1        4.076  -1.554  -0.403  0.00  0.00    +0.099 C 
ATOM     22  C   LIG    1        2.804  -0.700  -0.220  0.00  0.00    +0.100 C 
ATOM     23  N   LIG    1        2.822   0.097   1.030  0.00  0.00    -0.296 NA
ATOM     24  C   LIG    1        4.205   0.450   1.414  0.00  0.00    +0.100 C 
ATOM     25  C   LIG    1        5.208   0.511   0.240  0.00  0.00    +0.099 C 
ENDBRANCH  18  23
ENDBRANCH   1  18
TORSDOF 2