REMARK  Name = BDB026841
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.041  -2.038  -0.239  0.00  0.00    +0.129 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.600  -3.418  -0.515  0.00  0.00    +0.014 C 
ATOM      3  C   LIG    1       -2.074  -3.756  -0.496  0.00  0.00    +0.006 C 
ATOM      4  C   LIG    1       -1.325  -3.750  -1.800  0.00  0.00    +0.006 C 
ENDBRANCH   1   2
BRANCH   1   6
ATOM      5  O   LIG    1       -1.028  -0.361  -1.674  0.00  0.00    -0.290 OA
ATOM      6  C   LIG    1       -1.006  -0.868  -0.547  0.00  0.00    +0.182 C 
BRANCH   6   7
ATOM      7  C   LIG    1       -1.875  -0.365   0.527  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1       -2.756   0.769   0.468  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1       -3.385   0.883   1.709  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -4.313   1.889   2.003  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1       -4.610   2.812   0.997  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -4.003   2.729  -0.252  0.00  0.00    +0.001 A 
ATOM     13  N   LIG    1       -2.915  -0.140   2.496  0.00  0.00    -0.360 N 
ATOM     14  H   LIG    1       -3.206  -0.306   3.450  0.00  0.00    +0.165 HD
ATOM     15  C   LIG    1       -3.077   1.716  -0.528  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1       -2.008  -0.895   1.800  0.00  0.00    +0.095 A 
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   1  17
ATOM     17  N   LIG    1        1.170  -1.957  -1.094  0.00  0.00    -0.306 NA
ATOM     18  H   LIG    1        0.871  -1.623  -2.015  0.00  0.00    +0.123 HD
BRANCH  17  19
ATOM     19  C   LIG    1        2.226  -1.088  -0.564  0.00  0.00    +0.086 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.964   0.421  -0.683  0.00  0.00    +0.050 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.159   1.229  -0.234  0.00  0.00    -0.046 A 
ATOM     22  C   LIG    1        4.180   1.548  -1.141  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        5.293   2.280  -0.723  0.00  0.00    +0.020 A 
ATOM     24  C   LIG    1        5.391   2.694   0.604  0.00  0.00    +0.041 A 
ATOM     25 CL   LIG    1        6.763   3.595   1.120  0.00  0.00    -0.084 Cl
ATOM     26  C   LIG    1        4.386   2.381   1.516  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        3.273   1.648   1.099  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7