REMARK  Name = BDB014132
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.814  -1.084   0.459  0.00  0.00    +0.008 A 
ATOM      2  C   LIG    1        3.458  -0.767   0.580  0.00  0.00    +0.040 A 
ATOM      3  C   LIG    1        2.597  -1.686   1.176  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        3.031  -2.884   1.637  0.00  0.00    -0.253 NA
ATOM      5  C   LIG    1        4.338  -3.180   1.497  0.00  0.00    +0.112 A 
ATOM      6  C   LIG    1        5.257  -2.325   0.918  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        5.826   1.194  -0.064  0.00  0.00    +0.166 A 
ATOM      8  C   LIG    1        5.770  -0.179  -0.149  0.00  0.00    +0.124 A 
ATOM      9  N   LIG    1        6.835  -0.619  -0.896  0.00  0.00    -0.129 NA
ATOM     10  N   LIG    1        7.533   0.436  -1.292  0.00  0.00    -0.067 NA
ATOM     11  N   LIG    1        6.931   1.523  -0.793  0.00  0.00    -0.253 N 
ATOM     12  H   LIG    1        7.337   2.435  -0.978  0.00  0.00    +0.191 HD
BRANCH   7  14
ATOM     13  F   LIG    1        3.849   2.424  -0.012  0.00  0.00    -0.164 F 
ATOM     14  C   LIG    1        5.040   2.224   0.604  0.00  0.00    +0.436 C 
ATOM     15  F   LIG    1        4.779   1.924   1.896  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1        5.684   3.419   0.596  0.00  0.00    -0.164 F 
ENDBRANCH   7  14
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  C   LIG    1        1.169  -1.413   1.336  0.00  0.00    +0.107 A 
ATOM     18  N   LIG    1        0.335  -2.136   2.168  0.00  0.00    -0.234 NA
ATOM     19  C   LIG    1       -0.856  -1.599   2.042  0.00  0.00    +0.200 A 
ATOM     20  N   LIG    1       -0.840  -0.568   1.151  0.00  0.00    -0.336 N 
ATOM     21  C   LIG    1        0.444  -0.420   0.701  0.00  0.00    +0.117 A 
BRANCH  20  22
ATOM     22  C   LIG    1       -1.978   0.249   0.777  0.00  0.00    +0.131 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.499  -0.022  -0.652  0.00  0.00    +0.039 C 
ATOM     24  C   LIG    1       -3.583   0.990  -0.991  0.00  0.00    -0.039 A 
ATOM     25  C   LIG    1       -4.947   0.641  -0.986  0.00  0.00    -0.044 A 
ATOM     26  C   LIG    1       -5.909   1.621  -1.278  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -5.530   2.932  -1.560  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.184   3.278  -1.568  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.412  -0.777  -0.756  0.00  0.00    +0.035 C 
ATOM     30  C   LIG    1       -4.343  -1.690  -0.162  0.00  0.00    +0.005 C 
ATOM     31  C   LIG    1       -3.216   2.315  -1.288  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1       -3.003  -1.464  -0.852  0.00  0.00    +0.010 C 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   3  17
TORSDOF 5