REMARK  Name = BDB034618
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.402  -1.838  -0.392  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1       -0.260  -1.018  -0.249  0.00  0.00    +0.030 A 
ATOM      3  C   LIG    1        0.840  -1.377   0.545  0.00  0.00    +0.034 A 
ATOM      4  C   LIG    1        0.811  -2.588   1.227  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1       -0.299  -3.423   1.118  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1       -1.384  -3.052   0.322  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1       -2.644  -1.419  -1.322  0.00  0.00    +0.134 C 
ATOM      8  O   LIG    1       -2.365  -0.263  -2.197  0.00  0.00    -0.365 OA
ATOM      9  C   LIG    1       -2.224  -1.139  -3.341  0.00  0.00    +0.164 C 
ATOM     10  C   LIG    1       -2.862  -2.297  -2.588  0.00  0.00    +0.071 C 
BRANCH   7  11
ATOM     11  C   LIG    1       -3.951  -1.192  -0.534  0.00  0.00    +0.269 C 
ATOM     12  F   LIG    1       -4.449  -2.427  -0.208  0.00  0.00    -0.234 F 
BRANCH  11  15
ATOM     13  C   LIG    1       -3.523   1.921  -0.427  0.00  0.00    +0.151 C 
ATOM     14  N   LIG    1       -3.628   1.022   0.689  0.00  0.00    -0.318 N 
ATOM     15  C   LIG    1       -3.820  -0.338   0.683  0.00  0.00    +0.170 A 
ATOM     16  N   LIG    1       -3.891  -0.747   1.937  0.00  0.00    -0.132 NA
ATOM     17  N   LIG    1       -3.727   0.339   2.761  0.00  0.00    -0.138 NA
ATOM     18  C   LIG    1       -3.565   1.392   1.998  0.00  0.00    +0.224 A 
ENDBRANCH  11  15
ENDBRANCH   7  11
ENDBRANCH   1   7
BRANCH   3  19
ATOM     19  N   LIG    1        1.913  -0.470   0.603  0.00  0.00    -0.280 N 
ATOM     20  H   LIG    1        1.818   0.402   0.089  0.00  0.00    +0.155 HD
ATOM     21  C   LIG    1        3.107  -0.596   1.287  0.00  0.00    +0.267 C 
ATOM     22  O   LIG    1        3.483  -1.545   1.963  0.00  0.00    -0.268 OA
BRANCH  21  23
ATOM     23  C   LIG    1        3.994   0.606   1.129  0.00  0.00    +0.126 A 
ATOM     24  N   LIG    1        3.506   1.614   0.347  0.00  0.00    -0.238 NA
ATOM     25  C   LIG    1        4.289   2.721   0.190  0.00  0.00    +0.144 A 
ATOM     26  C   LIG    1        5.545   2.828   0.794  0.00  0.00    +0.032 A 
ATOM     27  C   LIG    1        6.016   1.781   1.584  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        5.230   0.648   1.758  0.00  0.00    +0.033 A 
BRANCH  25  29
ATOM     29  C   LIG    1        3.793   3.874  -0.676  0.00  0.00    +0.434 C 
ATOM     30  F   LIG    1        3.818   5.070  -0.019  0.00  0.00    -0.164 F 
ATOM     31  F   LIG    1        2.513   3.721  -1.118  0.00  0.00    -0.164 F 
ATOM     32  F   LIG    1        4.555   4.052  -1.793  0.00  0.00    -0.164 F 
ENDBRANCH  25  29
ENDBRANCH  21  23
ENDBRANCH   3  19
TORSDOF 6