REMARK  Name = BDB007525
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.141  -1.777  -1.956  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        0.813  -2.973  -1.834  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1        0.438  -3.692  -1.228  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        0.647  -0.756  -2.407  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1       -3.115  -0.402  -0.534  0.00  0.00    +0.031 A 
ATOM      6  C   LIG    1       -1.803  -0.529  -1.032  0.00  0.00    +0.036 A 
ATOM      7  C   LIG    1       -1.264  -1.758  -1.456  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -2.049  -2.908  -1.419  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1       -3.350  -2.822  -0.940  0.00  0.00    +0.003 A 
ATOM     10  C   LIG    1       -3.864  -1.592  -0.506  0.00  0.00    +0.023 A 
BRANCH   5  11
ATOM     11  N   LIG    1       -3.633   0.836  -0.121  0.00  0.00    -0.327 N 
BRANCH  11  12
ATOM     12  C   LIG    1       -5.054   0.965   0.292  0.00  0.00    +0.078 C 
ATOM     13  C   LIG    1       -5.232   0.647   1.786  0.00  0.00    +0.050 C 
ATOM     14  C   LIG    1       -6.397   1.420   2.390  0.00  0.00    +0.161 C 
ATOM     15  O   LIG    1       -7.453   1.529   1.443  0.00  0.00    -0.380 OA
ATOM     16  C   LIG    1       -7.126   2.379   0.342  0.00  0.00    +0.161 C 
ATOM     17  C   LIG    1       -5.648   2.336  -0.044  0.00  0.00    +0.050 C 
ENDBRANCH  11  12
BRANCH  11  19
ATOM     18  C   LIG    1       -2.389   2.858  -0.847  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1       -2.691   1.895   0.295  0.00  0.00    +0.102 C 
ENDBRANCH  11  19
ENDBRANCH   5  11
ENDBRANCH   1   7
BRANCH   2  20
ATOM     20  C   LIG    1        2.234  -3.106  -2.128  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.087  -3.171  -0.848  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1        2.517  -4.159   0.033  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1        3.096  -4.209   0.814  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1        3.202  -1.813  -0.118  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1        3.989  -0.812  -0.853  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1        3.708   0.555  -0.380  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1        4.644   1.028   0.707  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1        6.018   0.793   0.525  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1        6.943   1.276   1.451  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1        6.495   1.979   2.570  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        5.130   2.208   2.758  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        6.410   0.024  -0.707  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1        4.203   1.740   1.825  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1        5.429  -1.149  -0.900  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9