REMARK  Name = BDB057791
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.939  -1.772   0.299  0.00  0.00    +0.005 A 
ATOM      2  C   LIG    1        1.697  -0.621   0.082  0.00  0.00    -0.046 A 
ATOM      3  C   LIG    1        1.036   0.605   0.007  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -0.358   0.672   0.137  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1       -1.145  -0.472   0.347  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1       -0.455  -1.692   0.426  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   5   7
ATOM      7  N   LIG    1       -2.526  -0.404   0.477  0.00  0.00    -0.330 N 
ATOM      8  C   LIG    1       -3.192   0.853   0.829  0.00  0.00    +0.106 C 
ATOM      9  C   LIG    1       -4.513   0.574   1.539  0.00  0.00    +0.038 C 
ATOM     10  C   LIG    1       -5.474  -0.280   0.689  0.00  0.00    +0.060 C 
ATOM     11  C   LIG    1       -4.724  -1.107  -0.370  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1       -3.362  -1.562   0.150  0.00  0.00    +0.106 C 
BRANCH  10  13
ATOM     13  N   LIG    1       -6.616   0.507   0.194  0.00  0.00    -0.299 NA
ATOM     14  C   LIG    1       -6.314   1.604  -0.722  0.00  0.00    +0.085 C 
ATOM     15  C   LIG    1       -7.686   2.010  -1.246  0.00  0.00    +0.017 C 
ATOM     16  C   LIG    1       -8.589   0.807  -0.995  0.00  0.00    +0.017 C 
ATOM     17  C   LIG    1       -7.663  -0.274  -0.460  0.00  0.00    +0.085 C 
ENDBRANCH  10  13
ENDBRANCH   5   7
BRANCH   2  18
ATOM     18  C   LIG    1        3.200  -0.696  -0.036  0.00  0.00    +0.050 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.881  -0.618   1.343  0.00  0.00    +0.089 C 
BRANCH  19  20
ATOM     20  N   LIG    1        5.350  -0.604   1.372  0.00  0.00    -0.297 NA
ATOM     21  C   LIG    1        5.947   0.616   0.785  0.00  0.00    +0.149 C 
ATOM     22  C   LIG    1        6.926   0.171  -0.320  0.00  0.00    +0.184 C 
ATOM     23  O   LIG    1        8.281   0.191   0.161  0.00  0.00    -0.345 OA
ATOM     24  C   LIG    1        9.023   0.819  -0.883  0.00  0.00    +0.191 C 
ATOM     25  C   LIG    1        8.020   1.744  -1.515  0.00  0.00    +0.191 C 
ATOM     26  O   LIG    1        6.815   0.981  -1.497  0.00  0.00    -0.345 OA
ATOM     27  C   LIG    1        6.501  -1.255  -0.622  0.00  0.00    +0.081 C 
ATOM     28  C   LIG    1        5.990  -1.751   0.719  0.00  0.00    +0.090 C 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   2  18
TORSDOF 5