REMARK  Name = BDB007664
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.080   1.250  -0.181  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.641   0.325   0.172  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        0.242  -0.995   0.153  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1        0.802  -1.710   0.595  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.001   0.601   0.700  0.00  0.00    +0.041 A 
ATOM      6  C   LIG    1        3.038  -0.328   0.598  0.00  0.00    +0.056 A 
ATOM      7  C   LIG    1        4.288  -0.006   1.113  0.00  0.00    +0.120 A 
ATOM      8  N   LIG    1        4.510   1.170   1.731  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1        3.501   2.067   1.795  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        2.239   1.835   1.293  0.00  0.00    +0.033 A 
BRANCH   7  11
ATOM     11  N   LIG    1        5.300  -0.975   1.033  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1        5.349  -1.336   0.085  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1        6.619  -0.575   1.515  0.00  0.00    +0.139 C 
BRANCH  13  14
ATOM     14  C   LIG    1        7.445   0.025   0.410  0.00  0.00    -0.012 A 
ATOM     15  C   LIG    1        7.499   1.403   0.224  0.00  0.00    +0.115 A 
ATOM     16  N   LIG    1        8.215   2.010  -0.752  0.00  0.00    -0.263 NA
ATOM     17  C   LIG    1        8.903   1.206  -1.590  0.00  0.00    +0.111 A 
ATOM     18  C   LIG    1        8.909  -0.175  -1.499  0.00  0.00    +0.020 A 
ATOM     19  C   LIG    1        8.166  -0.773  -0.485  0.00  0.00    +0.008 A 
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  20
ATOM     20  C   LIG    1       -1.073  -1.384  -0.348  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -2.202  -1.034   0.635  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1       -1.911  -1.641   1.908  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1       -1.101  -1.200   2.222  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1       -3.575  -1.550   0.154  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -3.970  -1.130  -1.203  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1       -4.206   0.323  -1.319  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1       -5.511   0.808  -0.724  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -6.602  -0.066  -0.567  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1       -7.812   0.418  -0.053  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -7.947   1.764   0.282  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.874   2.636   0.112  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -6.451  -1.533  -0.885  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1       -5.663   2.162  -0.393  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1       -5.170  -1.845  -1.674  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 9