REMARK  Name = BDB026489
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.282  -3.912   2.958  0.00  0.00    +0.041 C 
ATOM      2  C   LIG    1        1.292  -3.037   1.706  0.00  0.00    +0.110 C 
ATOM      3  N   LIG    1        0.943  -1.647   1.998  0.00  0.00    -0.269 N 
ATOM      4  C   LIG    1        2.049  -0.817   1.881  0.00  0.00    +0.312 C 
ATOM      5  O   LIG    1        2.059   0.375   2.150  0.00  0.00    -0.252 OA
ATOM      6  N   LIG    1        3.096  -1.549   1.417  0.00  0.00    -0.218 N 
ATOM      7  C   LIG    1        2.743  -2.853   1.233  0.00  0.00    +0.247 C 
ATOM      8  O   LIG    1        3.464  -3.744   0.804  0.00  0.00    -0.273 OA
ATOM      9  C   LIG    1        0.454  -3.625   0.576  0.00  0.00    +0.041 C 
ENDROOT
BRANCH   3  10
ATOM     10  C   LIG    1       -0.327  -1.254   2.609  0.00  0.00    +0.143 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -1.020  -0.013   1.990  0.00  0.00    +0.146 C 
BRANCH  11  12
ATOM     12  O   LIG    1       -0.419   1.186   2.487  0.00  0.00    -0.389 OA
ATOM     13  H   LIG    1        0.542   1.132   2.293  0.00  0.00    +0.210 HD
ENDBRANCH  11  12
BRANCH  11  14
ATOM     14  C   LIG    1       -1.032  -0.053   0.440  0.00  0.00    +0.117 C 
BRANCH  14  15
ATOM     15  N   LIG    1       -1.881   0.904  -0.293  0.00  0.00    -0.295 NA
ATOM     16  C   LIG    1       -3.318   0.679  -0.080  0.00  0.00    +0.120 C 
ATOM     17  C   LIG    1       -4.193   1.665  -0.828  0.00  0.00    -0.030 A 
ATOM     18  C   LIG    1       -3.678   2.904  -1.254  0.00  0.00    -0.042 A 
ATOM     19  C   LIG    1       -4.512   3.814  -1.916  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -5.856   3.510  -2.132  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -6.374   2.293  -1.694  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -2.216   3.220  -1.056  0.00  0.00    +0.051 C 
ATOM     23  C   LIG    1       -5.548   1.376  -1.042  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -1.549   2.307  -0.016  0.00  0.00    +0.089 C 
ENDBRANCH  14  15
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   3  10
BRANCH   6  25
ATOM     25  C   LIG    1        4.336  -0.970   0.955  0.00  0.00    +0.173 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.245  -0.457  -0.474  0.00  0.00    +0.059 A 
ATOM     27  N   LIG    1        3.067  -0.587  -1.142  0.00  0.00    -0.257 NA
ATOM     28  C   LIG    1        3.000  -0.107  -2.408  0.00  0.00    +0.130 A 
ATOM     29  C   LIG    1        4.063   0.498  -3.057  0.00  0.00    +0.070 A 
ATOM     30  C   LIG    1        5.267   0.620  -2.365  0.00  0.00    +0.022 A 
ATOM     31  C   LIG    1        5.362   0.140  -1.059  0.00  0.00    +0.026 A 
BRANCH  29  32
ATOM     32  C   LIG    1        3.921   0.978  -4.394  0.00  0.00    +0.101 C 
ATOM     33  N   LIG    1        3.814   1.368  -5.481  0.00  0.00    -0.191 NA
ENDBRANCH  29  32
ENDBRANCH  25  26
ENDBRANCH   6  25
TORSDOF 8