REMARK  Name = BDB034412
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.099  -1.937   0.325  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -2.365  -1.808   1.060  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1       -2.248  -1.230   1.890  0.00  0.00    +0.146 HD
BRANCH   2   9
ATOM      4 CL   LIG    1       -4.973   4.427  -0.157  0.00  0.00    -0.083 Cl
ATOM      5  C   LIG    1       -4.494   2.780  -0.021  0.00  0.00    +0.043 A 
ATOM      6  C   LIG    1       -5.122   1.808  -0.795  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1       -4.759   0.473  -0.710  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1       -3.733   0.088   0.187  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1       -3.404  -1.292   0.241  0.00  0.00    +0.038 A 
ATOM     10  C   LIG    1       -4.063  -2.183  -0.606  0.00  0.00    +0.043 A 
ATOM     11  C   LIG    1       -5.048  -1.697  -1.440  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1       -3.100   1.091   0.962  0.00  0.00    +0.013 A 
ATOM     13  N   LIG    1       -5.403  -0.398  -1.502  0.00  0.00    -0.255 NA
ATOM     14  C   LIG    1       -3.480   2.429   0.859  0.00  0.00    +0.021 A 
ENDBRANCH   2   9
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.038  -2.525   1.256  0.00  0.00    +0.034 C 
BRANCH  15  16
ATOM     16  C   LIG    1        1.322  -2.703   0.574  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  N   LIG    1        2.282  -1.625   0.799  0.00  0.00    -0.312 NA
ATOM     18  H   LIG    1        2.433  -1.478   1.794  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.940  -0.362   0.153  0.00  0.00    +0.120 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.078   0.618   0.242  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1        3.870   0.927  -0.853  0.00  0.00    +0.171 A 
ATOM     22  O   LIG    1        3.731   0.428  -2.113  0.00  0.00    -0.452 OA
ATOM     23  C   LIG    1        4.824   1.078  -2.792  0.00  0.00    +0.466 C 
ATOM     24  O   LIG    1        5.565   1.983  -1.951  0.00  0.00    -0.453 OA
ATOM     25  C   LIG    1        4.917   1.819  -0.766  0.00  0.00    +0.167 A 
ATOM     26  C   LIG    1        5.239   2.457   0.412  0.00  0.00    +0.049 A 
ATOM     27  C   LIG    1        4.464   2.171   1.537  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        3.395   1.260   1.454  0.00  0.00    +0.009 A 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 7