REMARK  Name = BDB000203
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.616  -0.609   1.294  0.00  0.00    +0.159 C 
ATOM      2  C   LIG    1        0.383   0.461   1.776  0.00  0.00    +0.237 C 
ATOM      3  O   LIG    1        0.202   1.674   1.668  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1        1.513  -0.067   2.353  0.00  0.00    -0.285 N 
ATOM      5  C   LIG    1        1.688  -1.494   2.525  0.00  0.00    +0.077 C 
ATOM      6  C   LIG    1        3.122  -1.640   3.032  0.00  0.00    +0.025 C 
ATOM      7  C   LIG    1        3.359  -0.322   3.775  0.00  0.00    +0.034 C 
ATOM      8  C   LIG    1        1.397  -2.230   1.223  0.00  0.00    +0.025 C 
ATOM      9  C   LIG    1        2.616   0.709   2.921  0.00  0.00    +0.162 C 
ATOM     10  C   LIG    1        0.122  -1.720   0.529  0.00  0.00    +0.033 C 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -2.855  -0.591   0.213  0.00  0.00    +0.231 C 
ATOM     12  N   LIG    1       -1.643   0.004   0.473  0.00  0.00    -0.303 N 
ATOM     13  H   LIG    1       -1.429   0.854  -0.047  0.00  0.00    +0.149 HD
ATOM     14  O   LIG    1       -3.194  -1.660   0.710  0.00  0.00    -0.274 OA
BRANCH  11  15
ATOM     15  C   LIG    1       -3.758   0.259  -0.719  0.00  0.00    +0.140 C 
BRANCH  15  17
ATOM     16  C   LIG    1       -4.410  -1.606  -2.370  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1       -4.901  -0.576  -1.346  0.00  0.00    +0.009 C 
ATOM     18  C   LIG    1       -5.968   0.318  -1.986  0.00  0.00    +0.009 C 
ENDBRANCH  15  17
BRANCH  15  19
ATOM     19  N   LIG    1       -2.918   0.977  -1.710  0.00  0.00    -0.320 NA
ATOM     20  H   LIG    1       -2.467   0.286  -2.310  0.00  0.00    +0.119 HD
ATOM     21  H   LIG    1       -3.523   1.525  -2.319  0.00  0.00    +0.119 HD
ENDBRANCH  15  19
ENDBRANCH  11  15
ENDBRANCH   1  12
BRANCH   9  22
ATOM     22  C   LIG    1        3.486   1.274   1.775  0.00  0.00    +0.234 C 
ATOM     23  N   LIG    1        2.853   2.268   1.053  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1        1.853   2.377   1.224  0.00  0.00    +0.149 HD
ATOM     25  O   LIG    1        4.618   0.871   1.520  0.00  0.00    -0.274 OA
BRANCH  23  26
ATOM     26  C   LIG    1        3.319   2.649  -0.257  0.00  0.00    +0.139 C 
BRANCH  26  27
ATOM     27  C   LIG    1        2.655   1.796  -1.310  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1        3.261   0.610  -1.749  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        2.629  -0.201  -2.693  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        1.382   0.161  -3.201  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        0.763   1.329  -2.761  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        1.394   2.141  -1.817  0.00  0.00    +0.005 A 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH   9  22
TORSDOF 7