REMARK  Name = BDB026867
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.565   0.759   0.662  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.799   2.117   0.008  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.603   3.115   0.580  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.777   4.344  -0.062  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.140   4.600  -1.273  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.319   3.631  -1.843  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.145   2.402  -1.206  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -1.445   0.623   2.905  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -1.642   0.380   1.707  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -2.888  -0.282   1.290  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -3.466  -0.534  -0.006  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -4.666  -1.225   0.204  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -5.504  -1.647  -0.837  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -5.120  -1.355  -2.145  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.944  -0.661  -2.398  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -4.826  -1.374   1.559  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -5.615  -1.830   1.998  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -3.116  -0.247  -1.345  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -3.774  -0.810   2.218  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.788   0.776   1.288  0.00  0.00    -0.301 NA
ATOM     21  H   LIG    1        0.709   1.347   2.136  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.263  -0.566   1.644  0.00  0.00    +0.103 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.755  -0.547   2.001  0.00  0.00    +0.138 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.607  -0.449   0.832  0.00  0.00    -0.329 N 
ATOM     25  C   LIG    1        4.196  -1.488   0.153  0.00  0.00    +0.069 A 
ATOM     26  C   LIG    1        4.911  -0.860  -0.866  0.00  0.00    +0.089 A 
ATOM     27  C   LIG    1        5.650  -1.637  -1.770  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1        5.646  -3.029  -1.625  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        4.921  -3.637  -0.599  0.00  0.00    +0.002 A 
ATOM     30  N   LIG    1        4.760   0.504  -0.809  0.00  0.00    -0.236 NA
ATOM     31  C   LIG    1        4.178  -2.879   0.315  0.00  0.00    +0.028 A 
ATOM     32  C   LIG    1        3.967   0.719   0.216  0.00  0.00    +0.200 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7