REMARK  Name = BDB015975
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.511   1.915   0.432  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.265   0.835   0.216  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.564   0.892   0.570  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -2.105   2.030   1.172  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.223   3.081   1.349  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.074   3.058   0.986  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.824   0.552  -0.894  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.477   0.649  -0.508  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.930   1.835   0.029  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.794   2.936   0.164  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.135   2.861  -0.218  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.646   1.676  -0.745  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.869  -3.147  -2.217  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.705  -2.320  -2.015  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.507  -2.750  -2.444  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.677  -1.765  -2.089  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.339  -0.693  -1.443  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.659  -1.097  -1.410  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.483   2.135   1.614  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -4.275   3.259   1.486  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.490   2.932   2.018  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.654   3.779   2.114  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.549   1.672   2.482  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.326   1.191   2.245  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.379  -0.239   0.340  0.00  0.00    -0.325 N 
ATOM     26  H   LIG    1       -3.215   0.080  -0.148  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.755  -1.388  -0.335  0.00  0.00    +0.076 C 
ATOM     28  C   LIG    1       -0.860  -2.171   0.638  0.00  0.00    +0.050 C 
ATOM     29  C   LIG    1       -0.854  -3.665   0.340  0.00  0.00    +0.161 C 
ATOM     30  O   LIG    1       -0.979  -3.882  -1.061  0.00  0.00    -0.380 OA
ATOM     31  C   LIG    1       -2.268  -3.525  -1.557  0.00  0.00    +0.161 C 
ATOM     32  C   LIG    1       -2.863  -2.303  -0.865  0.00  0.00    +0.050 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5