REMARK  Name = BDB032361
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.459  -3.605   1.349  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -0.039  -2.416   0.531  0.00  0.00    -0.041 A 
ATOM      3  C   LIG    1       -0.940  -1.718  -0.287  0.00  0.00    -0.009 A 
ATOM      4  C   LIG    1       -0.418  -0.658  -1.022  0.00  0.00    +0.118 A 
ATOM      5  N   LIG    1        0.871  -0.241  -0.976  0.00  0.00    -0.240 NA
ATOM      6  C   LIG    1        1.723  -0.883  -0.156  0.00  0.00    +0.122 A 
ATOM      7  C   LIG    1        1.294  -1.979   0.594  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   6   8
ATOM      8  N   LIG    1        3.067  -0.464  -0.084  0.00  0.00    -0.306 N 
ATOM      9  C   LIG    1        3.450  -0.064   1.293  0.00  0.00    +0.182 C 
ATOM     10  C   LIG    1        4.770   0.632   1.360  0.00  0.00    +0.151 A 
ATOM     11  N   LIG    1        5.482   0.979   2.409  0.00  0.00    -0.132 NA
ATOM     12  N   LIG    1        6.620   1.607   1.952  0.00  0.00    -0.125 NA
ATOM     13  C   LIG    1        6.584   1.633   0.631  0.00  0.00    +0.238 A 
ATOM     14  N   LIG    1        5.421   1.037   0.228  0.00  0.00    -0.305 N 
ATOM     15  C   LIG    1        4.923   0.796  -1.110  0.00  0.00    +0.144 C 
ATOM     16  C   LIG    1        3.409   0.550  -1.103  0.00  0.00    +0.128 C 
BRANCH  13  17
ATOM     17  C   LIG    1        7.583   2.187  -0.311  0.00  0.00    +0.452 C 
ATOM     18  F   LIG    1        7.940   1.272  -1.253  0.00  0.00    -0.163 F 
ATOM     19  F   LIG    1        8.727   2.601   0.287  0.00  0.00    -0.163 F 
ATOM     20  F   LIG    1        7.084   3.253  -0.994  0.00  0.00    -0.163 F 
ENDBRANCH  13  17
ENDBRANCH   6   8
BRANCH   3  21
ATOM     21  C   LIG    1       -2.383  -2.138  -0.437  0.00  0.00    +0.138 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.263  -1.059  -0.882  0.00  0.00    -0.339 N 
ATOM     23  H   LIG    1       -3.940  -1.378  -1.570  0.00  0.00    +0.146 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -3.827  -0.163   0.027  0.00  0.00    +0.035 A 
ATOM     25  C   LIG    1       -4.886   0.647  -0.356  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1       -5.665   0.693  -1.629  0.00  0.00    +0.059 C 
ATOM     27  C   LIG    1       -6.898   1.491  -1.161  0.00  0.00    +0.108 C 
ATOM     28  N   LIG    1       -6.444   2.367  -0.088  0.00  0.00    -0.328 N 
ATOM     29  H   LIG    1       -7.080   2.688   0.633  0.00  0.00    +0.147 HD
ATOM     30  C   LIG    1       -5.401   1.611   0.508  0.00  0.00    +0.124 A 
ATOM     31  N   LIG    1       -4.963   1.822   1.748  0.00  0.00    -0.240 NA
ATOM     32  C   LIG    1       -3.909   1.062   2.111  0.00  0.00    +0.115 A 
ATOM     33  C   LIG    1       -3.311   0.093   1.300  0.00  0.00    +0.043 A 
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   3  21
TORSDOF 5