REMARK  Name = BDB008937
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.458  -0.519  -1.447  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.235   0.074  -1.791  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -0.867  -0.713  -2.157  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -0.716  -2.105  -2.204  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        0.506  -2.700  -1.883  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        1.594  -1.910  -1.507  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        3.541  -0.168  -0.216  0.00  0.00    -0.306 N 
ATOM      8  H   LIG    1        3.345  -1.060   0.219  0.00  0.00    +0.149 HD
ATOM      9  C   LIG    1        2.583   0.373  -1.051  0.00  0.00    +0.244 C 
ATOM     10  O   LIG    1        2.611   1.540  -1.430  0.00  0.00    -0.270 OA
BRANCH   7  14
ATOM     11  C   LIG    1        6.579   2.031   2.073  0.00  0.00    +0.105 C 
ATOM     12  N   LIG    1        5.440   1.125   2.237  0.00  0.00    -0.302 NA
ATOM     13  C   LIG    1        5.569  -0.036   1.332  0.00  0.00    +0.107 C 
ATOM     14  C   LIG    1        4.655   0.660   0.301  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1        4.281   1.614   1.456  0.00  0.00    +0.107 C 
ENDBRANCH   7  14
ENDBRANCH   1   9
BRANCH   3  16
ATOM     16  C   LIG    1       -2.181  -0.066  -2.530  0.00  0.00    +0.092 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.359  -0.574  -1.703  0.00  0.00    +0.069 A 
ATOM     18  C   LIG    1       -3.539  -0.100  -0.295  0.00  0.00    -0.016 A 
ATOM     19  C   LIG    1       -2.609   0.917   0.308  0.00  0.00    +0.037 C 
ATOM     20  C   LIG    1       -3.139   1.528   1.609  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -3.727   0.457   2.518  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -4.872  -0.283   1.825  0.00  0.00    +0.041 C 
ATOM     23  C   LIG    1       -4.571  -0.623   0.391  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -5.483  -1.595  -0.262  0.00  0.00    +0.268 A 
ATOM     25  O   LIG    1       -6.441  -2.082   0.330  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1       -5.193  -1.908  -1.562  0.00  0.00    -0.243 N 
ATOM     27  H   LIG    1       -5.805  -2.570  -2.026  0.00  0.00    +0.192 HD
ATOM     28  N   LIG    1       -4.149  -1.427  -2.287  0.00  0.00    -0.175 NA
ENDBRANCH  16  17
ENDBRANCH   3  16
TORSDOF 4