REMARK  Name = BDB028476
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.660   1.978   1.389  0.00  0.00    -0.253 OA
ATOM      2  C   LIG    1       -0.688   1.613   0.218  0.00  0.00    +0.302 C 
ATOM      3  N   LIG    1       -1.775   1.832  -0.621  0.00  0.00    -0.284 N 
ATOM      4  C   LIG    1       -2.917   2.543  -0.040  0.00  0.00    +0.124 C 
ATOM      5  C   LIG    1       -3.820   1.608   0.787  0.00  0.00    +0.103 C 
ATOM      6  N   LIG    1       -4.849   0.855   0.046  0.00  0.00    -0.297 NA
ATOM      7  C   LIG    1       -4.478   0.376  -1.291  0.00  0.00    +0.086 C 
ATOM      8  C   LIG    1       -3.043  -0.121  -1.504  0.00  0.00    +0.034 C 
ATOM      9  C   LIG    1       -2.069   1.020  -1.799  0.00  0.00    +0.110 C 
ATOM     10  N   LIG    1        0.360   0.950  -0.370  0.00  0.00    -0.297 N 
ATOM     11  H   LIG    1        0.522   1.273  -1.312  0.00  0.00    +0.150 HD
ENDROOT
BRANCH   6  12
ATOM     12  C   LIG    1       -5.392  -0.215   0.905  0.00  0.00    +0.119 C 
BRANCH  12  13
ATOM     13  C   LIG    1       -6.745  -0.730   0.458  0.00  0.00    -0.033 A 
ATOM     14  C   LIG    1       -6.964  -2.106   0.292  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -8.217  -2.582  -0.099  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -9.265  -1.690  -0.321  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -9.063  -0.322  -0.152  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -7.811   0.155   0.239  0.00  0.00    +0.005 A 
ENDBRANCH  12  13
ENDBRANCH   6  12
BRANCH  10  19
ATOM     19  C   LIG    1        1.579   0.707   0.403  0.00  0.00    +0.138 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.448  -0.350  -0.293  0.00  0.00    +0.146 C 
BRANCH  20  21
ATOM     21  O   LIG    1        1.679  -1.553  -0.462  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        0.750  -1.267  -0.555  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        3.720  -0.686   0.511  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.617   0.459   0.758  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        5.679   0.105   1.722  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        6.816  -0.717   1.151  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        7.091  -0.712  -0.229  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        8.172  -1.453  -0.725  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        8.990  -2.175   0.144  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        8.731  -2.167   1.512  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.190   0.034  -1.180  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        7.653  -1.439   2.015  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        5.242   1.004  -0.459  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH  10  19
TORSDOF 7