REMARK  Name = BDB032703
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.374  -0.445   0.943  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.398   0.545   1.002  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -2.335   1.500   1.751  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.401   0.229  -0.026  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.739  -0.996  -0.592  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -0.952  -1.544  -1.587  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1        0.178  -0.829  -2.005  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1        0.512   0.423  -1.434  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -0.290   0.954  -0.414  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -2.961  -1.540   0.068  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -7.952  -0.322  -0.133  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.966  -0.362   0.598  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.530  -1.553   1.121  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -7.077  -2.365   0.870  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.316  -1.810   1.714  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -4.947  -2.972   1.883  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.404  -0.601   1.978  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.287   0.641   2.151  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.139   0.860   0.910  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1        1.751   1.156  -1.885  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.838   0.712  -1.072  0.00  0.00    -0.446 OA
BRANCH  21  22
ATOM     22  C   LIG    1        4.020   1.284  -1.395  0.00  0.00    +0.401 C 
ATOM     23  N   LIG    1        4.984   0.807  -0.562  0.00  0.00    -0.281 N 
ATOM     24  H   LIG    1        4.646   0.266   0.219  0.00  0.00    +0.152 HD
ATOM     25  O   LIG    1        4.189   2.106  -2.282  0.00  0.00    -0.226 OA
BRANCH  23  26
ATOM     26  C   LIG    1        6.308   1.370  -0.543  0.00  0.00    +0.111 C 
BRANCH  26  27
ATOM     27  C   LIG    1        7.299   0.545   0.220  0.00  0.00    +0.006 C 
ATOM     28  C   LIG    1        7.189  -0.954   0.358  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1        6.987  -0.072   1.562  0.00  0.00    +0.005 C 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 6