REMARK  Name = BDB018437
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.743  -1.721   0.246  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1       -0.314  -1.794   0.596  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.194  -3.003   0.913  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1       -0.568  -4.158   0.925  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.074  -5.410   1.298  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -1.920  -4.157   0.613  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -2.648  -5.145   0.613  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -2.495  -2.838   0.251  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -3.747   1.825  -0.851  0.00  0.00    +0.214 A 
ATOM     10  N   LIG    1       -4.017   1.285   0.356  0.00  0.00    -0.221 NA
ATOM     11  C   LIG    1       -3.356   0.147   0.671  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1       -2.438  -0.486  -0.166  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -2.191   0.100  -1.409  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -2.855   1.274  -1.758  0.00  0.00    +0.068 A 
BRANCH   9  16
ATOM     15  C   LIG    1       -5.236   3.523  -0.246  0.00  0.00    +0.279 C 
ATOM     16  O   LIG    1       -4.379   2.986  -1.248  0.00  0.00    -0.480 OA
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1        0.523  -0.631   0.607  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1        1.734  -0.493  -0.037  0.00  0.00    +0.123 A 
ATOM     19  N   LIG    1        2.204   0.780   0.234  0.00  0.00    -0.238 N 
ATOM     20  N   LIG    1        1.345   1.440   1.040  0.00  0.00    -0.174 NA
ATOM     21  C   LIG    1        0.336   0.598   1.255  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1        3.410   1.391  -0.233  0.00  0.00    +0.083 A 
ATOM     23  C   LIG    1        3.807   2.685   0.171  0.00  0.00    +0.077 A 
ATOM     24  C   LIG    1        5.006   3.226  -0.337  0.00  0.00    +0.021 A 
ATOM     25  C   LIG    1        5.804   2.510  -1.227  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        5.416   1.237  -1.623  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        4.231   0.680  -1.133  0.00  0.00    +0.029 A 
BRANCH  23  28
ATOM     28  C   LIG    1        3.091   3.528   1.094  0.00  0.00    +0.101 C 
ATOM     29  N   LIG    1        2.608   4.286   1.829  0.00  0.00    -0.191 NA
ENDBRANCH  23  28
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 5