REMARK  Name = BDB018653
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.017   0.456  -0.052  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1        1.282  -0.698  -0.372  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -0.060  -0.606  -0.745  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1       -0.769  -1.766  -1.065  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -0.275  -2.643  -1.182  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -2.110  -1.800  -1.345  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1       -2.911  -0.555  -0.988  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -3.281  -0.621   0.501  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1       -4.535   0.177   0.624  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1       -5.143   0.330  -0.722  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1       -2.113   0.713  -1.330  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1       -4.298  -0.542  -1.641  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1       -2.621  -2.833  -1.772  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -0.694   0.635  -0.830  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1        0.029   1.791  -0.528  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        1.367   1.699  -0.134  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1        5.721  -0.358  -0.074  0.00  0.00    +0.052 A 
ATOM     18  C   LIG    1        4.377  -0.274  -0.461  0.00  0.00    +0.027 A 
ATOM     19  C   LIG    1        3.428   0.367   0.354  0.00  0.00    -0.017 A 
ATOM     20  C   LIG    1        3.866   0.922   1.569  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1        5.205   0.839   1.960  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        6.132   0.200   1.139  0.00  0.00    +0.019 A 
BRANCH  17  24
ATOM     23  N   LIG    1        7.438  -1.550  -1.611  0.00  0.00    -0.191 NA
ATOM     24  C   LIG    1        6.671  -1.015  -0.922  0.00  0.00    +0.099 C 
ENDBRANCH  17  24
ENDBRANCH   1  19
BRANCH   9  25
ATOM     25  C   LIG    1       -5.176   0.405   1.776  0.00  0.00    +0.169 C 
ATOM     26  N   LIG    1       -5.729   0.605   2.773  0.00  0.00    -0.174 NA
ENDBRANCH   9  25
TORSDOF 3