REMARK  Name = BDB034368
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.314  -1.668   1.049  0.00  0.00    -0.343 N 
ATOM      2  H   LIG    1        0.383  -0.748   1.477  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.057  -2.027   0.926  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1       -2.089  -1.076   0.706  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -3.399  -1.574   0.536  0.00  0.00    +0.073 A 
ATOM      6  C   LIG    1       -4.438  -0.677   0.315  0.00  0.00    +0.032 A 
ATOM      7  C   LIG    1       -4.243   0.712   0.240  0.00  0.00    -0.042 A 
ATOM      8  C   LIG    1       -2.948   1.201   0.413  0.00  0.00    +0.004 A 
ATOM      9  N   LIG    1       -3.695  -2.884   0.568  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1       -2.687  -3.758   0.761  0.00  0.00    +0.113 A 
ATOM     11  C   LIG    1       -1.886   0.323   0.639  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -1.371  -3.386   0.930  0.00  0.00    +0.043 A 
BRANCH   7  13
ATOM     13  C   LIG    1       -5.393   1.677  -0.008  0.00  0.00    +0.019 C 
ATOM     14  C   LIG    1       -6.198   1.337  -1.281  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1       -7.705   1.468  -1.085  0.00  0.00    +0.001 C 
ATOM     16  C   LIG    1       -8.181   0.604   0.075  0.00  0.00    +0.000 C 
ATOM     17  C   LIG    1       -7.399   0.834   1.370  0.00  0.00    +0.001 C 
ATOM     18  C   LIG    1       -6.275   1.858   1.242  0.00  0.00    +0.008 C 
ENDBRANCH   7  13
ENDBRANCH   1   3
BRANCH   1  19
ATOM     19  C   LIG    1        0.999  -1.712  -0.250  0.00  0.00    +0.103 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.482  -1.363  -0.091  0.00  0.00    +0.034 C 
BRANCH  20  21
ATOM     21  C   LIG    1        2.701   0.133   0.154  0.00  0.00    +0.083 C 
BRANCH  21  22
ATOM     22  N   LIG    1        4.111   0.498   0.285  0.00  0.00    -0.312 NA
ATOM     23  H   LIG    1        4.602  -0.196   0.849  0.00  0.00    +0.122 HD
BRANCH  22  24
ATOM     24  C   LIG    1        4.790   0.612  -1.007  0.00  0.00    +0.120 C 
BRANCH  24  26
ATOM     25  C   LIG    1        7.299   0.104  -0.991  0.00  0.00    +0.125 A 
ATOM     26  C   LIG    1        6.236   1.014  -0.813  0.00  0.00    +0.011 A 
ATOM     27  C   LIG    1        6.520   2.335  -0.420  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1        7.832   2.740  -0.224  0.00  0.00    +0.124 A 
ATOM     29  F   LIG    1        8.089   4.000   0.152  0.00  0.00    -0.205 F 
ATOM     30  C   LIG    1        8.883   1.853  -0.408  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1        8.617   0.536  -0.792  0.00  0.00    +0.049 A 
BRANCH  25  33
ATOM     32  C   LIG    1        7.992  -2.123  -1.497  0.00  0.00    +0.277 C 
ATOM     33  O   LIG    1        6.948  -1.169  -1.356  0.00  0.00    -0.495 OA
ENDBRANCH  25  33
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 9