REMARK  Name = BDB026337
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.265   1.828   0.944  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1        0.045   0.725   0.003  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1        1.487   0.748  -0.557  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1        2.462   0.632   0.543  0.00  0.00    -0.324 N 
ATOM      5  C   LIG    1        2.077   1.264   1.819  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1        0.956   2.311   1.621  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.777   0.249   0.305  0.00  0.00    +0.085 A 
ATOM      8  C   LIG    1        4.382   0.179  -0.971  0.00  0.00    +0.235 A 
ATOM      9  F   LIG    1        3.675   0.547  -2.053  0.00  0.00    -0.182 F 
ATOM     10  N   LIG    1        5.654  -0.205  -1.233  0.00  0.00    -0.213 NA
ATOM     11  C   LIG    1        6.401  -0.556  -0.159  0.00  0.00    +0.129 A 
ATOM     12  C   LIG    1        5.930  -0.542   1.143  0.00  0.00    +0.035 A 
ATOM     13  C   LIG    1        4.612  -0.139   1.365  0.00  0.00    +0.030 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.808  -0.987  -0.441  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1        8.166  -0.923  -1.770  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1        7.424  -0.684  -2.424  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        9.429  -1.409  -2.254  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        8.551  -1.368   0.457  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.305   1.443   1.908  0.00  0.00    +0.119 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.933  -0.734  -0.462  0.00  0.00    +0.106 A 
ATOM     21  C   LIG    1       -6.277  -1.890   0.295  0.00  0.00    +0.271 A 
ATOM     22  O   LIG    1       -6.819  -2.982   0.370  0.00  0.00    -0.266 OA
ATOM     23  N   LIG    1       -5.064  -1.612   0.870  0.00  0.00    -0.319 N 
ATOM     24  H   LIG    1       -4.612  -2.360   1.376  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1       -4.475  -0.348   0.763  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1       -5.143   0.656   0.047  0.00  0.00    +0.088 A 
ATOM     27  C   LIG    1       -4.549   1.913  -0.057  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1       -3.312   2.165   0.542  0.00  0.00    +0.007 A 
ATOM     29  C   LIG    1       -2.644   1.158   1.258  0.00  0.00    -0.031 A 
ATOM     30  C   LIG    1       -3.239  -0.107   1.365  0.00  0.00    +0.032 A 
ATOM     31  N   LIG    1       -6.388   0.443  -0.573  0.00  0.00    -0.245 NA
BRANCH  20  33
ATOM     32  C   LIG    1       -8.053  -1.679  -2.474  0.00  0.00    +0.010 C 
ATOM     33  C   LIG    1       -8.259  -1.012  -1.126  0.00  0.00    +0.057 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5