REMARK  Name = BDB007573
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.050  -1.516  -1.537  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        0.289  -1.827  -1.508  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1        0.789  -1.696  -0.635  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -1.677  -1.284  -2.564  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1       -0.808  -3.584   0.685  0.00  0.00    +0.044 C 
ATOM      6  C   LIG    1       -1.562  -2.293   0.832  0.00  0.00    -0.038 A 
ATOM      7  C   LIG    1       -1.697  -1.359  -0.208  0.00  0.00    +0.041 A 
ATOM      8  C   LIG    1       -2.466  -0.194  -0.029  0.00  0.00    +0.036 A 
ATOM      9  C   LIG    1       -3.103   0.080   1.183  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1       -2.893  -0.817   2.237  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1       -2.149  -1.990   2.066  0.00  0.00    +0.006 A 
BRANCH   9  12
ATOM     12  N   LIG    1       -3.820   1.249   1.435  0.00  0.00    -0.339 N 
ATOM     13  H   LIG    1       -4.461   1.157   2.223  0.00  0.00    +0.146 HD
BRANCH  12  14
ATOM     14  C   LIG    1       -4.375   2.065   0.345  0.00  0.00    +0.098 C 
ATOM     15  C   LIG    1       -5.063   3.304   0.921  0.00  0.00    +0.182 C 
ATOM     16  O   LIG    1       -6.408   2.919   1.262  0.00  0.00    -0.378 OA
ATOM     17  C   LIG    1       -6.700   1.679   0.601  0.00  0.00    +0.162 C 
ATOM     18  C   LIG    1       -5.544   1.381  -0.333  0.00  0.00    +0.052 C 
ENDBRANCH  12  14
ENDBRANCH   9  12
ENDBRANCH   1   7
BRANCH   2  19
ATOM     19  C   LIG    1        1.105  -1.786  -2.706  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.398  -0.365  -3.220  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.420  -0.428  -4.226  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        2.473   0.452  -4.635  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        1.784   0.647  -2.108  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        2.685   0.143  -1.049  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        2.719   1.102   0.075  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        3.703   0.728   1.162  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        4.780  -0.134   0.892  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        5.698  -0.441   1.906  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        5.562   0.125   3.173  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        4.507   0.994   3.439  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.905  -0.778  -0.464  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        3.583   1.297   2.438  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        4.054  -0.084  -1.538  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 8