REMARK  Name = BDB034306
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.183  -0.105  -0.201  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -2.402  -0.074   0.609  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1       -2.345   0.636   1.336  0.00  0.00    +0.146 HD
BRANCH   2   9
ATOM      4 CL   LIG    1       -8.605   0.554   3.339  0.00  0.00    -0.083 Cl
ATOM      5  C   LIG    1       -7.169   0.357   2.411  0.00  0.00    +0.043 A 
ATOM      6  C   LIG    1       -7.253   0.150   1.038  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1       -6.116  -0.015   0.262  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1       -4.838   0.044   0.873  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1       -3.689  -0.107   0.040  0.00  0.00    +0.038 A 
ATOM     10  C   LIG    1       -3.899  -0.392  -1.310  0.00  0.00    +0.043 A 
ATOM     11  C   LIG    1       -5.191  -0.432  -1.800  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1       -4.777   0.240   2.275  0.00  0.00    +0.013 A 
ATOM     13  N   LIG    1       -6.288  -0.235  -1.047  0.00  0.00    -0.255 NA
ATOM     14  C   LIG    1       -5.934   0.398   3.038  0.00  0.00    +0.021 A 
ENDBRANCH   2   9
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.742  -1.549  -0.445  0.00  0.00    +0.034 C 
BRANCH  15  16
ATOM     16  C   LIG    1        0.461  -1.646  -1.386  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.633  -0.981  -0.822  0.00  0.00    -0.311 NA
ATOM     18  H   LIG    1        1.886  -1.425   0.062  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1        2.782  -1.078  -1.726  0.00  0.00    +0.123 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.971  -0.413  -1.102  0.00  0.00    +0.005 A 
ATOM     21  S   LIG    1        5.256  -1.344  -0.472  0.00  0.00    -0.092 S 
ATOM     22  C   LIG    1        6.141   0.050   0.015  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        5.455   1.225  -0.301  0.00  0.00    -0.011 A 
ATOM     24  C   LIG    1        6.053   2.462   0.040  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        7.299   2.495   0.673  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        7.963   1.315   0.976  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        7.397   0.079   0.654  0.00  0.00    +0.015 A 
ATOM     28  C   LIG    1        4.206   0.937  -0.944  0.00  0.00    +0.021 A 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 7