REMARK  Name = BDB034970
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.196  -1.483   2.856  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -2.874  -0.952   1.488  0.00  0.00    -0.020 A 
ATOM      3  C   LIG    1       -1.681  -0.265   1.262  0.00  0.00    +0.092 A 
ATOM      4  C   LIG    1       -1.458   0.186  -0.057  0.00  0.00    +0.092 A 
ATOM      5  C   LIG    1       -0.274   0.866  -0.293  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1        0.656   1.094   0.727  0.00  0.00    -0.021 A 
ATOM      7  C   LIG    1        0.338   0.614   1.985  0.00  0.00    +0.115 A 
ATOM      8  N   LIG    1       -2.320  -0.006  -1.077  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -3.458  -0.663  -0.822  0.00  0.00    +0.117 A 
ATOM     10  N   LIG    1       -0.799  -0.056   2.268  0.00  0.00    -0.253 NA
ATOM     11  C   LIG    1       -3.770  -1.157   0.431  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   9  12
ATOM     12  N   LIG    1       -4.315  -0.866  -1.899  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -5.251  -0.534  -1.702  0.00  0.00    +0.144 HD
ATOM     14  H   LIG    1       -3.905  -0.388  -2.699  0.00  0.00    +0.144 HD
ENDBRANCH   9  12
BRANCH   6  15
ATOM     15  C   LIG    1        1.944   1.830   0.469  0.00  0.00    +0.092 C 
BRANCH  15  16
ATOM     16  C   LIG    1        2.886   1.107  -0.466  0.00  0.00    +0.046 A 
ATOM     17  N   LIG    1        3.062   1.645  -1.699  0.00  0.00    -0.260 NA
ATOM     18  C   LIG    1        3.892   0.998  -2.547  0.00  0.00    +0.111 A 
ATOM     19  C   LIG    1        4.566  -0.167  -2.227  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        4.380  -0.705  -0.960  0.00  0.00    +0.003 A 
ATOM     21  C   LIG    1        3.529  -0.063  -0.064  0.00  0.00    +0.023 A 
ENDBRANCH  15  16
ENDBRANCH   6  15
TORSDOF 3