REMARK  Name = BDB003404
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.744   0.431   1.958  0.00  0.00    +0.081 A 
ATOM      2  C   LIG    1       -1.872   1.134   1.289  0.00  0.00    +0.281 A 
ATOM      3  O   LIG    1       -2.214   2.271   1.572  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1       -2.405   0.228   0.370  0.00  0.00    -0.219 N 
ATOM      5  N   LIG    1       -1.737  -1.003   0.493  0.00  0.00    -0.294 N 
ATOM      6  H   LIG    1       -1.335  -1.308  -0.396  0.00  0.00    +0.187 HD
ATOM      7  C   LIG    1       -0.746  -0.816   1.454  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1        0.121  -1.969   1.831  0.00  0.00    +0.066 C 
ENDROOT
BRANCH   4   9
ATOM      9  C   LIG    1       -3.520   0.361  -0.484  0.00  0.00    +0.067 A 
ATOM     10  C   LIG    1       -4.011  -0.742  -1.202  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1       -5.110  -0.615  -2.058  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -5.737   0.618  -2.209  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -5.265   1.722  -1.504  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -4.166   1.593  -0.648  0.00  0.00    +0.028 A 
ENDBRANCH   4   9
BRANCH   1  16
ATOM     15  N   LIG    1        1.351   0.994   3.264  0.00  0.00    -0.187 NA
ATOM     16  C   LIG    1        0.079   1.048   3.009  0.00  0.00    +0.145 C 
BRANCH  15  18
ATOM     17  C   LIG    1        2.284   0.767   1.030  0.00  0.00    +0.281 C 
ATOM     18  N   LIG    1        2.216   0.402   2.377  0.00  0.00    -0.202 N 
ATOM     19  H   LIG    1        3.116   0.221   2.811  0.00  0.00    +0.178 HD
ATOM     20  O   LIG    1        1.501   1.540   0.486  0.00  0.00    -0.267 OA
BRANCH  17  26
ATOM     21  C   LIG    1        5.836  -0.508  -2.345  0.00  0.00    +0.067 C 
ATOM     22  C   LIG    1        4.932  -0.433  -1.173  0.00  0.00    +0.060 A 
ATOM     23  N   LIG    1        5.028  -1.330  -0.185  0.00  0.00    -0.178 NA
ATOM     24  N   LIG    1        4.069  -0.967   0.678  0.00  0.00    -0.272 N 
ATOM     25  H   LIG    1        3.932  -1.546   1.500  0.00  0.00    +0.189 HD
ATOM     26  C   LIG    1        3.373   0.151   0.307  0.00  0.00    +0.122 A 
ATOM     27  C   LIG    1        3.907   0.503  -0.918  0.00  0.00    +0.057 A 
ENDBRANCH  17  26
ENDBRANCH  15  18
ENDBRANCH   1  16
TORSDOF 4