REMARK  Name = BDB019533
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.796  -0.992  -0.679  0.00  0.00    +0.049 A 
ATOM      2  C   LIG    1       -4.434  -0.974  -0.958  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1       -3.619  -0.182  -1.902  0.00  0.00    +0.248 C 
ATOM      4  N   LIG    1       -2.306  -0.590  -1.759  0.00  0.00    -0.293 N 
ATOM      5  C   LIG    1       -2.138  -1.623  -0.765  0.00  0.00    +0.144 C 
ATOM      6  O   LIG    1       -4.027   0.676  -2.662  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1       -3.539  -1.832  -0.291  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1       -3.971  -2.732   0.670  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -5.330  -2.771   0.964  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -6.226  -1.915   0.299  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1       -6.539   0.862  -2.138  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1       -7.293   1.363  -2.584  0.00  0.00    +0.145 HD
ATOM     13  H   LIG    1       -5.599   1.023  -2.498  0.00  0.00    +0.145 HD
ATOM     14  C   LIG    1       -6.864  -0.150  -1.292  0.00  0.00    +0.242 C 
ATOM     15  O   LIG    1       -8.047  -0.354  -1.031  0.00  0.00    -0.270 OA
ENDBRANCH   1  14
BRANCH   4  16
ATOM     16  C   LIG    1       -1.185  -0.044  -2.503  0.00  0.00    +0.109 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -0.752   1.345  -2.032  0.00  0.00    +0.034 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.191   1.396  -0.605  0.00  0.00    +0.086 C 
BRANCH  18  19
ATOM     19  N   LIG    1        0.930   0.475  -0.362  0.00  0.00    -0.299 NA
ATOM     20  C   LIG    1        1.162   0.328   1.095  0.00  0.00    +0.103 C 
ATOM     21  C   LIG    1        2.561  -0.218   1.463  0.00  0.00    +0.120 C 
ATOM     22  N   LIG    1        3.616   0.683   0.974  0.00  0.00    -0.327 N 
ATOM     23  C   LIG    1        3.267   1.538  -0.169  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        2.179   0.876  -1.051  0.00  0.00    +0.103 C 
BRANCH  22  25
ATOM     25  C   LIG    1        4.846   0.770   1.605  0.00  0.00    +0.030 A 
ATOM     26  C   LIG    1        5.330  -0.262   2.428  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1        6.573  -0.183   3.068  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        7.373   0.941   2.901  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.926   1.979   2.093  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        5.681   1.889   1.456  0.00  0.00    +0.023 A 
ENDBRANCH  22  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   4  16
TORSDOF 6