REMARK  Name = BDB027762
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.626  -0.562   0.126  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1        0.520  -1.897  -0.298  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -0.739  -2.281  -0.762  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1       -0.854  -3.595  -1.190  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.135  -4.528  -1.188  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.329  -4.129  -0.719  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -1.790  -1.449  -0.798  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1       -1.588  -0.194  -0.366  0.00  0.00    +0.164 A 
ATOM      9  C   LIG    1        1.571  -2.845  -0.269  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.427   0.271   0.114  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -2.747   0.703  -0.357  0.00  0.00    +0.040 A 
ATOM     12  C   LIG    1       -2.703   2.034  -0.796  0.00  0.00    +0.070 A 
ATOM     13 CL   LIG    1       -1.300   2.775  -1.481  0.00  0.00    -0.081 Cl
ATOM     14  C   LIG    1       -3.864   2.797  -0.723  0.00  0.00    +0.131 A 
ATOM     15  N   LIG    1       -5.052   2.344  -0.259  0.00  0.00    -0.262 NA
ATOM     16  C   LIG    1       -5.085   1.061   0.146  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1       -3.984   0.221   0.114  0.00  0.00    +0.033 A 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  N   LIG    1        1.871  -0.085   0.599  0.00  0.00    -0.328 N 
ATOM     19  H   LIG    1        2.564  -0.249  -0.127  0.00  0.00    +0.147 HD
BRANCH  18  20
ATOM     20  C   LIG    1        1.866   1.317   1.022  0.00  0.00    +0.102 C 
BRANCH  20  22
ATOM     21  C   LIG    1        4.328   1.776   0.550  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1        3.230   1.698   1.602  0.00  0.00    +0.015 C 
ENDBRANCH  20  22
ENDBRANCH  18  20
ENDBRANCH   1  18
TORSDOF 4