REMARK  Name = BDB002333
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.747   0.233   0.149  0.00  0.00    +0.234 C 
ATOM      2  N   LIG    1       -1.037  -0.944   0.234  0.00  0.00    -0.303 N 
ATOM      3  H   LIG    1       -1.230  -1.657  -0.461  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -1.393   1.274   0.704  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        0.301  -0.981   0.814  0.00  0.00    +0.156 C 
ATOM      6  C   LIG    1        0.456  -2.196   1.717  0.00  0.00    +0.038 C 
BRANCH   5   7
ATOM      7  C   LIG    1        1.334  -1.047  -0.334  0.00  0.00    +0.237 C 
ATOM      8  N   LIG    1        2.598  -0.638   0.062  0.00  0.00    -0.283 N 
ATOM      9  H   LIG    1        2.663  -0.272   0.999  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        1.009  -1.475  -1.440  0.00  0.00    -0.273 OA
BRANCH   8  11
ATOM     11  C   LIG    1        3.798  -0.616  -0.699  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1        4.999  -0.101  -0.104  0.00  0.00    +0.003 A 
ATOM     13  C   LIG    1        6.190  -0.097  -0.880  0.00  0.00    -0.016 A 
ATOM     14  C   LIG    1        7.392   0.396  -0.344  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1        7.451   0.893   0.955  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        6.306   0.904   1.735  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        6.179  -0.586  -2.192  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        5.011  -1.081  -2.755  0.00  0.00    +0.002 A 
ATOM     19  C   LIG    1        5.102   0.416   1.216  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1        3.832  -1.097  -2.015  0.00  0.00    +0.024 A 
ENDBRANCH   8  11
ENDBRANCH   5   7
ENDBRANCH   2   5
BRANCH   1  21
ATOM     21  C   LIG    1       -3.045   0.150  -0.683  0.00  0.00    +0.161 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -4.058   0.826   0.130  0.00  0.00    -0.302 N 
ATOM     23  H   LIG    1       -3.841   1.787   0.369  0.00  0.00    +0.150 HD
ATOM     24  C   LIG    1       -4.813   0.114   1.039  0.00  0.00    +0.230 C 
ATOM     25  O   LIG    1       -4.836  -1.115   1.072  0.00  0.00    -0.274 OA
BRANCH  24  26
ATOM     26  C   LIG    1       -5.648   0.990   1.999  0.00  0.00    +0.135 C 
ATOM     27  C   LIG    1       -4.751   1.669   3.026  0.00  0.00    +0.033 C 
BRANCH  26  28
ATOM     28  N   LIG    1       -6.650   0.157   2.694  0.00  0.00    -0.320 NA
ATOM     29  H   LIG    1       -7.199  -0.327   1.980  0.00  0.00    +0.119 HD
ATOM     30  H   LIG    1       -6.146  -0.605   3.156  0.00  0.00    +0.119 HD
ENDBRANCH  26  28
ENDBRANCH  24  26
ENDBRANCH  21  22
BRANCH  21  32
ATOM     31  C   LIG    1       -4.189   0.815  -2.845  0.00  0.00    +0.009 C 
ATOM     32  C   LIG    1       -2.879   0.849  -2.049  0.00  0.00    +0.012 C 
ATOM     33  C   LIG    1       -1.768   0.212  -2.888  0.00  0.00    +0.009 C 
ENDBRANCH  21  32
ENDBRANCH   1  21
TORSDOF 8