REMARK  Name = BDB026652
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.740   2.271  -1.553  0.00  0.00    -0.297 NA
ATOM      2  C   LIG    1        0.974   2.691  -0.377  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -0.560   2.503  -0.466  0.00  0.00    +0.122 C 
ATOM      4  N   LIG    1       -0.996   1.103  -0.276  0.00  0.00    -0.314 N 
ATOM      5  C   LIG    1       -0.037   0.029  -0.574  0.00  0.00    +0.108 C 
ATOM      6  C   LIG    1        0.550   0.037  -1.980  0.00  0.00    +0.034 C 
ATOM      7  C   LIG    1        1.095   1.370  -2.496  0.00  0.00    +0.086 C 
ENDROOT
BRANCH   4   8
ATOM      8  C   LIG    1       -2.272   0.847  -0.815  0.00  0.00    +0.129 A 
ATOM      9  C   LIG    1       -3.213   0.156  -0.056  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1       -2.931  -0.318   1.343  0.00  0.00    +0.124 C 
ATOM     11  N   LIG    1       -4.140  -0.716   2.096  0.00  0.00    -0.301 NA
ATOM     12  C   LIG    1       -4.975  -1.606   1.279  0.00  0.00    +0.090 C 
ATOM     13  C   LIG    1       -5.512  -0.846   0.065  0.00  0.00    +0.071 C 
ATOM     14  C   LIG    1       -3.766  -1.355   3.356  0.00  0.00    +0.105 C 
ATOM     15  C   LIG    1       -4.423  -0.122  -0.679  0.00  0.00    +0.052 A 
ATOM     16  N   LIG    1       -4.708   0.270  -1.938  0.00  0.00    -0.240 NA
ATOM     17  C   LIG    1       -3.743   0.949  -2.566  0.00  0.00    +0.223 A 
ATOM     18  N   LIG    1       -2.537   1.255  -2.071  0.00  0.00    -0.220 NA
ENDBRANCH   4   8
BRANCH   1  19
ATOM     19  C   LIG    1        3.182   2.149  -1.374  0.00  0.00    +0.119 C 
BRANCH  19  23
ATOM     20  C   LIG    1        4.587  -1.482   0.533  0.00  0.00    +0.120 A 
ATOM     21  C   LIG    1        4.222  -0.381   1.305  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1        3.771   0.793   0.689  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1        3.671   0.883  -0.706  0.00  0.00    -0.033 A 
ATOM     24  C   LIG    1        4.053  -0.225  -1.473  0.00  0.00    +0.008 A 
ATOM     25  C   LIG    1        4.502  -1.396  -0.857  0.00  0.00    +0.046 A 
BRANCH  20  27
ATOM     26  C   LIG    1        5.165  -2.812   2.416  0.00  0.00    +0.277 C 
ATOM     27  O   LIG    1        5.038  -2.683   1.005  0.00  0.00    -0.495 OA
ENDBRANCH  20  27
ENDBRANCH  19  23
ENDBRANCH   1  19
TORSDOF 4