REMARK  Name = BDB055664
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.473   2.452  -0.680  0.00  0.00    +0.216 A 
ATOM      2  N   LIG    1        0.318   1.113  -0.288  0.00  0.00    -0.317 N 
ATOM      3  C   LIG    1        1.570   0.603  -0.199  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1        2.449   1.611  -0.555  0.00  0.00    +0.108 A 
ATOM      5  C   LIG    1        3.831   1.350  -0.564  0.00  0.00    +0.143 A 
ATOM      6  N   LIG    1        4.355   0.134  -0.231  0.00  0.00    -0.235 NA
ATOM      7  C   LIG    1        3.447  -0.793   0.114  0.00  0.00    +0.140 A 
ATOM      8  N   LIG    1        3.700  -2.079   0.498  0.00  0.00    -0.346 N 
ATOM      9  H   LIG    1        4.627  -2.475   0.561  0.00  0.00    +0.167 HD
ATOM     10  C   LIG    1        2.512  -2.714   0.785  0.00  0.00    +0.085 A 
ATOM     11  C   LIG    1        1.474  -1.821   0.577  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1        2.080  -0.616   0.147  0.00  0.00    +0.044 A 
ATOM     13  N   LIG    1        1.756   2.750  -0.848  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   2  14
ATOM     14  C   LIG    1       -0.985   0.479  -0.084  0.00  0.00    +0.089 C 
ATOM     15  C   LIG    1       -1.258   0.069   1.374  0.00  0.00    +0.025 C 
ATOM     16  C   LIG    1       -2.288  -1.056   1.495  0.00  0.00    +0.002 C 
ATOM     17  C   LIG    1       -3.350  -0.965   0.407  0.00  0.00    +0.000 C 
ATOM     18  C   LIG    1       -2.756  -1.105  -0.996  0.00  0.00    +0.002 C 
ATOM     19  C   LIG    1       -1.315  -0.599  -1.124  0.00  0.00    +0.025 C 
ENDBRANCH   2  14
BRANCH   1  21
ATOM     20  F   LIG    1       -0.289   4.648  -1.225  0.00  0.00    -0.163 F 
ATOM     21  C   LIG    1       -0.677   3.394  -0.881  0.00  0.00    +0.451 C 
ATOM     22  F   LIG    1       -1.429   3.514   0.247  0.00  0.00    -0.163 F 
ATOM     23  F   LIG    1       -1.515   2.961  -1.861  0.00  0.00    -0.163 F 
ENDBRANCH   1  21
TORSDOF 2