REMARK  Name = BDB014690
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.045   0.268  -0.146  0.00  0.00    -0.293 N 
ATOM      2  H   LIG    1        0.012  -0.746  -0.197  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -6.248  -2.379  -1.253  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -4.753  -2.196  -1.208  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.263  -1.103  -0.502  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -2.792  -1.011  -0.406  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.376   0.340   0.050  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.092   0.935   0.160  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -1.188   2.173   0.655  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.505   2.396   0.795  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.949   3.687   1.260  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.256   1.310   0.478  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.727   1.153   0.530  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.061  -0.354   0.495  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -4.015  -2.992  -1.789  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.381   0.735  -0.210  0.00  0.00    +0.104 A 
ATOM     17  C   LIG    1        2.413  -0.160   0.132  0.00  0.00    +0.155 A 
ATOM     18  F   LIG    1        2.062  -1.424   0.433  0.00  0.00    -0.203 F 
ATOM     19  C   LIG    1        3.768   0.214   0.157  0.00  0.00    +0.022 A 
ATOM     20  C   LIG    1        4.093   1.538  -0.168  0.00  0.00    +0.014 A 
ATOM     21  C   LIG    1        3.091   2.444  -0.517  0.00  0.00    +0.041 A 
ATOM     22  C   LIG    1        1.754   2.043  -0.537  0.00  0.00    +0.147 A 
ATOM     23  F   LIG    1        0.854   2.943  -0.960  0.00  0.00    -0.203 F 
BRANCH  19  24
ATOM     24  C   LIG    1        4.803  -0.741   0.522  0.00  0.00    +0.022 A 
ATOM     25  C   LIG    1        6.121  -0.688   0.113  0.00  0.00    +0.116 A 
ATOM     26  N   LIG    1        6.742  -1.769   0.669  0.00  0.00    -0.274 N 
ATOM     27  C   LIG    1        8.127  -2.146   0.525  0.00  0.00    +0.172 C 
ATOM     28  N   LIG    1        5.926  -2.530   1.416  0.00  0.00    -0.179 NA
ATOM     29  C   LIG    1        4.746  -1.910   1.320  0.00  0.00    +0.143 A 
ENDBRANCH  19  24
ENDBRANCH   1  16
TORSDOF 3