REMARK  Name = BDB035923
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.067  -3.216   0.691  0.00  0.00    +0.121 C 
ENDROOT
BRANCH   1   7
ATOM      2  C   LIG    1        4.942   1.901   1.655  0.00  0.00    +0.046 C 
ATOM      3  C   LIG    1        4.667   1.263   0.313  0.00  0.00    -0.010 C 
ATOM      4  C   LIG    1        3.741   0.109   0.351  0.00  0.00    +0.071 A 
ATOM      5  C   LIG    1        3.380  -0.564  -0.808  0.00  0.00    -0.014 A 
ATOM      6  C   LIG    1        2.507  -1.656  -0.705  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1        2.008  -2.048   0.538  0.00  0.00    -0.015 A 
ATOM      8  C   LIG    1        2.442  -1.321   1.636  0.00  0.00    +0.116 A 
ATOM      9  C   LIG    1        3.916  -0.159  -2.142  0.00  0.00    +0.116 C 
ATOM     10  C   LIG    1        4.778   1.077  -2.141  0.00  0.00    +0.172 C 
ATOM     11  O   LIG    1        5.131   1.564  -3.215  0.00  0.00    -0.292 OA
ATOM     12  N   LIG    1        3.288  -0.267   1.566  0.00  0.00    -0.255 NA
ATOM     13  C   LIG    1        5.196   1.700  -0.854  0.00  0.00    +0.102 C 
BRANCH  13  14
ATOM     14  C   LIG    1        6.204   2.784  -1.064  0.00  0.00    +0.421 C 
ATOM     15  F   LIG    1        7.236   2.391  -1.858  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        6.796   3.200   0.087  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1        5.655   3.892  -1.623  0.00  0.00    -0.166 F 
ENDBRANCH  13  14
ENDBRANCH   1   7
BRANCH   1  18
ATOM     18  N   LIG    1       -0.364  -2.932   0.596  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1       -0.935  -2.224   1.754  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1       -2.304  -1.571   1.456  0.00  0.00    +0.122 C 
ATOM     21  N   LIG    1       -2.149  -0.559   0.399  0.00  0.00    -0.313 N 
ATOM     22  C   LIG    1       -1.222  -0.898  -0.694  0.00  0.00    +0.122 C 
ATOM     23  C   LIG    1       -0.836  -2.398  -0.689  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1       -3.275   0.208   0.117  0.00  0.00    +0.122 A 
ATOM     25  N   LIG    1       -4.444  -0.100   0.733  0.00  0.00    -0.235 NA
ATOM     26  C   LIG    1       -5.498   0.681   0.444  0.00  0.00    +0.073 A 
ATOM     27  C   LIG    1       -6.888   0.525   0.998  0.00  0.00    +0.153 C 
ATOM     28  C   LIG    1       -7.624   1.684   0.316  0.00  0.00    +0.223 C 
ATOM     29  N   LIG    1       -6.713   2.355  -0.493  0.00  0.00    -0.284 N 
ATOM     30  H   LIG    1       -6.959   3.162  -1.046  0.00  0.00    +0.155 HD
ATOM     31  O   LIG    1       -8.800   1.978   0.449  0.00  0.00    -0.275 OA
ATOM     32  C   LIG    1       -5.465   1.763  -0.416  0.00  0.00    +0.056 A 
ATOM     33  C   LIG    1       -4.299   2.111  -1.040  0.00  0.00    +0.028 A 
ATOM     34  C   LIG    1       -3.184   1.314  -0.758  0.00  0.00    +0.045 A 
ENDBRANCH  21  24
ENDBRANCH   1  18
TORSDOF 4