REMARK  Name = BDB055766
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.925   0.627   0.194  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1        0.400   1.087   0.354  0.00  0.00    +0.055 A 
ATOM      3  C   LIG    1        0.644   2.420   0.700  0.00  0.00    +0.029 A 
ATOM      4  C   LIG    1       -0.402   3.341   0.902  0.00  0.00    -0.042 A 
ATOM      5  C   LIG    1       -1.713   2.859   0.738  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -1.974   1.528   0.391  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -3.294  -4.147  -0.729  0.00  0.00    +0.105 C 
ATOM      8  N   LIG    1       -3.279  -2.701  -0.937  0.00  0.00    -0.302 NA
ATOM      9  C   LIG    1       -2.130  -2.312  -1.789  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1       -1.654  -0.864  -1.548  0.00  0.00    +0.120 C 
ATOM     11  N   LIG    1       -1.137  -0.729  -0.164  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1       -1.892  -1.505   0.852  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1       -3.280  -1.960   0.344  0.00  0.00    +0.103 C 
ENDBRANCH   1  11
BRANCH   2  14
ATOM     14  N   LIG    1        1.409   0.123   0.147  0.00  0.00    -0.280 N 
ATOM     15  H   LIG    1        1.015  -0.791  -0.070  0.00  0.00    +0.155 HD
ATOM     16  C   LIG    1        2.772   0.270   0.230  0.00  0.00    +0.250 C 
ATOM     17  O   LIG    1        3.383   1.304   0.480  0.00  0.00    -0.270 OA
BRANCH  16  18
ATOM     18  C   LIG    1        3.569  -0.945  -0.093  0.00  0.00    +0.055 A 
ATOM     19  C   LIG    1        3.264  -2.239   0.349  0.00  0.00    +0.053 A 
ATOM     20 CL   LIG    1        1.935  -2.602   1.392  0.00  0.00    -0.083 Cl
ATOM     21  C   LIG    1        4.082  -3.314  -0.026  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1        5.204  -3.106  -0.829  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.522  -1.820  -1.258  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.712  -0.745  -0.888  0.00  0.00    +0.014 A 
ENDBRANCH  16  18
ENDBRANCH   2  14
BRANCH   4  25
ATOM     25  C   LIG    1       -0.076   4.776   1.277  0.00  0.00    +0.019 C 
ATOM     26  C   LIG    1       -0.957   5.560   2.220  0.00  0.00    +0.009 C 
ATOM     27  C   LIG    1       -0.906   5.928   0.765  0.00  0.00    +0.009 C 
ENDBRANCH   4  25
TORSDOF 4