REMARK  Name = BDB014153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.051  -0.531  -0.750  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1        2.020  -1.538  -1.661  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1        3.179  -1.846  -2.276  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1        4.378  -1.204  -2.023  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1        4.404  -0.181  -1.073  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        3.213   0.168  -0.435  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        5.655   0.500  -0.805  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1        6.119   1.009   0.387  0.00  0.00    +0.166 A 
ATOM      9  N   LIG    1        7.346   1.515   0.071  0.00  0.00    -0.253 N 
ATOM     10  H   LIG    1        8.027   1.978   0.666  0.00  0.00    +0.191 HD
ATOM     11  N   LIG    1        7.644   1.317  -1.219  0.00  0.00    -0.067 NA
ATOM     12  N   LIG    1        6.616   0.687  -1.769  0.00  0.00    -0.129 NA
BRANCH   8  13
ATOM     13  C   LIG    1        5.618   1.073   1.755  0.00  0.00    +0.436 C 
ATOM     14  F   LIG    1        6.617   1.373   2.626  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1        4.678   2.035   1.902  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1        5.078  -0.096   2.167  0.00  0.00    -0.164 F 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  N   LIG    1       -1.302  -0.158   0.499  0.00  0.00    -0.336 N 
ATOM     18  C   LIG    1       -0.420  -0.807  -0.315  0.00  0.00    +0.117 A 
ATOM     19  C   LIG    1        0.794  -0.188  -0.098  0.00  0.00    +0.107 A 
ATOM     20  N   LIG    1        0.654   0.819   0.839  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1       -0.616   0.805   1.179  0.00  0.00    +0.200 A 
BRANCH  17  22
ATOM     22  C   LIG    1       -2.716  -0.445   0.628  0.00  0.00    +0.127 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.552   0.370  -0.358  0.00  0.00    +0.059 C 
BRANCH  23  28
ATOM     24  F   LIG    1       -7.839   0.676   1.972  0.00  0.00    -0.202 F 
ATOM     25  C   LIG    1       -7.129   0.218   0.932  0.00  0.00    +0.159 A 
ATOM     26  C   LIG    1       -5.775   0.519   0.824  0.00  0.00    +0.162 A 
ATOM     27  F   LIG    1       -5.182   1.264   1.768  0.00  0.00    -0.202 F 
ATOM     28  C   LIG    1       -5.020   0.046  -0.255  0.00  0.00    -0.008 A 
ATOM     29  C   LIG    1       -5.655  -0.744  -1.225  0.00  0.00    +0.006 A 
ATOM     30  C   LIG    1       -7.018  -1.044  -1.114  0.00  0.00    +0.003 A 
ATOM     31  C   LIG    1       -7.756  -0.561  -0.033  0.00  0.00    +0.041 A 
ENDBRANCH  23  28
ENDBRANCH  22  23
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 6