REMARK  Name = BDB032276
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.155   0.654  -0.441  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -0.512   0.833   0.726  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1        0.781   0.438   0.798  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        1.481  -0.145  -0.251  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        0.800  -0.301  -1.458  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.531   0.104  -1.554  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1       -2.480   1.095  -0.470  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1       -2.618   1.452   0.477  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1       -3.449   0.048  -0.790  0.00  0.00    +0.106 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -8.597  -0.671   0.847  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -7.141  -0.567   0.913  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -6.484  -1.297  -0.178  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -5.908  -0.390  -1.264  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -4.882   0.608  -0.695  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1       -5.235   1.002   0.753  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1       -6.727   0.838   1.029  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1        2.919  -0.546  -0.090  0.00  0.00    +0.138 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.761   0.641  -0.139  0.00  0.00    -0.340 N 
ATOM     19  H   LIG    1        3.427   1.330  -0.810  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        5.152   0.519  -0.146  0.00  0.00    +0.029 A 
ATOM     21  C   LIG    1        5.836  -0.604   0.334  0.00  0.00    +0.031 A 
ATOM     22  C   LIG    1        7.244  -0.662   0.375  0.00  0.00    -0.012 A 
ATOM     23  C   LIG    1        8.002   0.447  -0.048  0.00  0.00    +0.019 A 
ATOM     24  C   LIG    1        9.399   0.312   0.021  0.00  0.00    +0.120 A 
ATOM     25  N   LIG    1       10.053  -0.791   0.458  0.00  0.00    -0.263 NA
ATOM     26  C   LIG    1        9.290  -1.824   0.858  0.00  0.00    +0.111 A 
ATOM     27  C   LIG    1        7.314   1.597  -0.492  0.00  0.00    +0.052 A 
ATOM     28 CL   LIG    1        8.153   3.021  -1.010  0.00  0.00    -0.083 Cl
ATOM     29  C   LIG    1        7.905  -1.808   0.837  0.00  0.00    +0.028 A 
ATOM     30  C   LIG    1        5.915   1.629  -0.524  0.00  0.00    +0.043 A 
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 6