REMARK  Name = BDB015735
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.892  -0.221  -0.360  0.00  0.00    +0.326 A 
ATOM      2  N   LIG    1       -1.810   1.114  -0.405  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1       -0.660   1.657   0.035  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        0.375   0.887   0.531  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        0.191  -0.478   0.535  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1       -0.939  -1.045   0.107  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -0.597   3.140  -0.003  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1        0.543   3.765  -0.361  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1        0.644   5.148  -0.418  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1        1.914   5.736  -0.813  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -0.427   5.988  -0.121  0.00  0.00    +0.251 A 
ATOM     12  O   LIG    1       -0.392   7.215  -0.146  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -1.695   5.307   0.244  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -1.756   3.971   0.290  0.00  0.00    +0.017 A 
ENDBRANCH   3   7
BRANCH   5  15
ATOM     15  N   LIG    1        1.155  -1.365   1.022  0.00  0.00    -0.326 N 
ATOM     16  H   LIG    1        0.711  -2.278   0.899  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1        2.451  -1.310   0.345  0.00  0.00    +0.072 C 
ATOM     18  C   LIG    1        3.093  -2.703   0.319  0.00  0.00    +0.022 C 
ATOM     19  C   LIG    1        4.584  -2.418   0.351  0.00  0.00    +0.002 C 
ATOM     20  C   LIG    1        4.686  -1.293   1.365  0.00  0.00    +0.002 C 
ATOM     21  C   LIG    1        3.454  -0.428   1.108  0.00  0.00    +0.022 C 
ENDBRANCH  15  17
ENDBRANCH   5  15
BRANCH   1  22
ATOM     22  O   LIG    1       -3.095  -0.743  -0.824  0.00  0.00    -0.422 OA
BRANCH  22  25
ATOM     23  C   LIG    1       -4.388  -2.102   1.319  0.00  0.00    +0.047 C 
ATOM     24  C   LIG    1       -3.825  -2.818   0.124  0.00  0.00    -0.007 A 
ATOM     25  C   LIG    1       -3.167  -2.115  -0.901  0.00  0.00    +0.153 A 
ATOM     26  C   LIG    1       -2.659  -2.796  -2.017  0.00  0.00    +0.084 A 
ATOM     27 CL   LIG    1       -1.907  -1.960  -3.328  0.00  0.00    -0.080 Cl
ATOM     28  C   LIG    1       -2.766  -4.185  -2.093  0.00  0.00    +0.024 A 
ATOM     29  C   LIG    1       -3.388  -4.893  -1.065  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1       -3.914  -4.215   0.036  0.00  0.00    +0.007 A 
ENDBRANCH  22  25
ENDBRANCH   1  22
TORSDOF 5