REMARK  Name = BDB032348
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.040   0.134  -0.312  0.00  0.00    -0.012 A 
ATOM      2  C   LIG    1        0.925   0.654   0.538  0.00  0.00    +0.118 A 
ATOM      3  N   LIG    1        2.096   0.039   0.828  0.00  0.00    -0.240 NA
ATOM      4  C   LIG    1        2.347  -1.159   0.265  0.00  0.00    +0.122 A 
ATOM      5  C   LIG    1        1.436  -1.749  -0.609  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        0.238  -1.099  -0.901  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        3.564  -1.819   0.530  0.00  0.00    -0.306 N 
ATOM      8  C   LIG    1        4.176  -1.422   1.827  0.00  0.00    +0.182 C 
ATOM      9  C   LIG    1        5.162  -0.302   1.747  0.00  0.00    +0.151 A 
ATOM     10  N   LIG    1        5.812   0.316   2.709  0.00  0.00    -0.132 NA
ATOM     11  N   LIG    1        6.623   1.265   2.125  0.00  0.00    -0.125 NA
ATOM     12  C   LIG    1        6.458   1.206   0.815  0.00  0.00    +0.238 A 
ATOM     13  N   LIG    1        5.564   0.208   0.544  0.00  0.00    -0.305 N 
ATOM     14  C   LIG    1        5.079  -0.273  -0.733  0.00  0.00    +0.144 C 
ATOM     15  C   LIG    1        4.502  -1.694  -0.608  0.00  0.00    +0.128 C 
BRANCH  12  16
ATOM     16  C   LIG    1        7.100   2.029  -0.234  0.00  0.00    +0.452 C 
ATOM     17  F   LIG    1        6.180   2.558  -1.088  0.00  0.00    -0.163 F 
ATOM     18  F   LIG    1        7.827   3.065   0.250  0.00  0.00    -0.163 F 
ATOM     19  F   LIG    1        7.938   1.283  -1.006  0.00  0.00    -0.163 F 
ENDBRANCH  12  16
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1       -1.316   0.881  -0.598  0.00  0.00    +0.139 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -2.455   0.036  -0.255  0.00  0.00    -0.324 N 
ATOM     22  H   LIG    1       -2.416  -0.246   0.721  0.00  0.00    +0.148 HD
BRANCH  21  26
ATOM     23  C   LIG    1       -7.304  -0.198  -0.108  0.00  0.00    +0.124 A 
ATOM     24  C   LIG    1       -6.136   0.529  -0.415  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1       -4.892  -0.094  -0.183  0.00  0.00    +0.027 A 
ATOM     26  C   LIG    1       -3.713   0.634  -0.489  0.00  0.00    +0.127 A 
ATOM     27  N   LIG    1       -3.748   1.878  -1.015  0.00  0.00    -0.240 NA
ATOM     28  C   LIG    1       -4.950   2.451  -1.217  0.00  0.00    +0.113 A 
ATOM     29  C   LIG    1       -4.895  -1.404   0.333  0.00  0.00    +0.032 A 
ATOM     30  C   LIG    1       -6.101  -2.018   0.611  0.00  0.00    +0.113 A 
ATOM     31  C   LIG    1       -6.150   1.833  -0.933  0.00  0.00    +0.032 A 
ATOM     32  N   LIG    1       -7.299  -1.441   0.406  0.00  0.00    -0.240 NA
BRANCH  23  33
ATOM     33  N   LIG    1       -8.581   0.334  -0.318  0.00  0.00    -0.343 N 
ATOM     34  H   LIG    1       -8.709   0.581  -1.293  0.00  0.00    +0.144 HD
ATOM     35  H   LIG    1       -9.235  -0.395  -0.040  0.00  0.00    +0.144 HD
ENDBRANCH  23  33
ENDBRANCH  21  26
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 6