REMARK  Name = BDB003183
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.559   1.209   0.454  0.00  0.00    -0.294 N 
ATOM      2  C   LIG    1        0.247   1.650   0.550  0.00  0.00    +0.240 C 
ATOM      3  O   LIG    1       -0.089   2.580   1.283  0.00  0.00    -0.271 OA
ENDROOT
BRANCH   1   5
ATOM      4  C   LIG    1        3.131   3.099   0.778  0.00  0.00    +0.024 C 
ATOM      5  C   LIG    1        2.543   1.818   1.351  0.00  0.00    +0.105 C 
ENDBRANCH   1   5
BRANCH   2   6
ATOM      6  C   LIG    1       -0.787   0.943  -0.256  0.00  0.00    +0.068 C 
ATOM      7  C   LIG    1       -2.021   1.462  -0.353  0.00  0.00    +0.015 C 
BRANCH   7   8
ATOM      8  C   LIG    1       -3.093   0.801  -1.103  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1       -3.761  -0.362  -0.693  0.00  0.00    +0.133 A 
ATOM     10  C   LIG    1       -4.798  -0.933  -1.444  0.00  0.00    +0.033 A 
ATOM     11  C   LIG    1       -5.177  -0.331  -2.641  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -4.529   0.827  -3.073  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -3.498   1.390  -2.310  0.00  0.00    +0.010 A 
BRANCH   9  14
ATOM     14  N   LIG    1       -3.412  -1.014   0.552  0.00  0.00    +0.057 N 
ATOM     15  O   LIG    1       -2.372  -1.687   0.565  0.00  0.00    -0.126 OA
ATOM     16  O   LIG    1       -4.205  -0.886   1.494  0.00  0.00    -0.126 OA
ENDBRANCH   9  14
ENDBRANCH   7   8
ENDBRANCH   2   6
BRANCH   1  17
ATOM     17  C   LIG    1        2.080   0.289  -0.560  0.00  0.00    +0.143 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.412  -1.086  -0.025  0.00  0.00    -0.030 A 
ATOM     19  C   LIG    1        3.576  -1.738  -0.463  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1        3.889  -3.022  -0.012  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.037  -3.676   0.875  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        1.872  -3.048   1.308  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        1.559  -1.763   0.859  0.00  0.00    +0.005 A 
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6