REMARK  Name = BDB055873
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.926   2.821  -0.046  0.00  0.00    +0.086 C 
ATOM      2  C   LIG    1       -0.556   2.559  -0.209  0.00  0.00    +0.220 C 
ATOM      3  O   LIG    1       -1.270   3.523  -0.508  0.00  0.00    -0.275 OA
ATOM      4  N   LIG    1       -1.032   1.264  -0.156  0.00  0.00    -0.293 N 
ATOM      5  C   LIG    1       -0.201   0.086   0.195  0.00  0.00    +0.114 C 
ATOM      6  C   LIG    1        1.328   0.329   0.059  0.00  0.00    +0.045 C 
ATOM      7  C   LIG    1        1.682   1.693   0.644  0.00  0.00    +0.023 C 
ENDROOT
BRANCH   5   8
ATOM      8  C   LIG    1       -0.587  -1.148  -0.624  0.00  0.00    -0.026 A 
ATOM      9  C   LIG    1       -0.886  -2.359   0.023  0.00  0.00    +0.007 A 
ATOM     10  C   LIG    1       -1.218  -3.496  -0.717  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1       -1.250  -3.434  -2.108  0.00  0.00    +0.041 A 
ATOM     12 CL   LIG    1       -1.657  -4.838  -3.016  0.00  0.00    -0.084 Cl
ATOM     13  C   LIG    1       -0.951  -2.245  -2.767  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -0.618  -1.107  -2.029  0.00  0.00    +0.007 A 
ENDBRANCH   5   8
BRANCH   6  15
ATOM     15  C   LIG    1        2.170  -0.769   0.704  0.00  0.00    -0.041 A 
ATOM     16  C   LIG    1        2.143  -1.014   2.086  0.00  0.00    +0.024 A 
ATOM     17  C   LIG    1        2.913  -2.041   2.636  0.00  0.00    +0.041 A 
ATOM     18 CL   LIG    1        2.861  -2.329   4.332  0.00  0.00    -0.084 Cl
ATOM     19  C   LIG    1        3.718  -2.836   1.824  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        3.753  -2.603   0.451  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        2.984  -1.578  -0.105  0.00  0.00    +0.004 A 
ENDBRANCH   6  15
BRANCH   1  22
ATOM     22  C   LIG    1        1.530   3.285  -1.379  0.00  0.00    +0.133 C 
BRANCH  22  24
ATOM     23  O   LIG    1        1.620   1.684  -3.174  0.00  0.00    -0.251 OA
ATOM     24  C   LIG    1        1.011   2.579  -2.607  0.00  0.00    +0.305 C 
BRANCH  24  25
ATOM     25  O   LIG    1       -0.198   3.006  -3.027  0.00  0.00    -0.481 OA
ATOM     26  H   LIG    1       -0.645   3.646  -2.425  0.00  0.00    +0.295 HD
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   1  22
BRANCH   4  27
ATOM     27  C   LIG    1       -2.493   1.107  -0.124  0.00  0.00    +0.112 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -3.006   1.241   1.282  0.00  0.00    +0.006 C 
ATOM     29  C   LIG    1       -4.394   0.757   1.619  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1       -3.195   0.038   2.170  0.00  0.00    +0.005 C 
ENDBRANCH  27  28
ENDBRANCH   4  27
TORSDOF 7