REMARK  Name = BDB002435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.621   0.076  -0.281  0.00  0.00    +0.091 C 
ATOM      2  C   LIG    1        1.861   0.890   0.772  0.00  0.00    +0.040 C 
ATOM      3  C   LIG    1        0.723   1.650   0.094  0.00  0.00    +0.087 C 
ATOM      4  N   LIG    1       -0.282   0.759  -0.513  0.00  0.00    -0.295 NA
ATOM      5  C   LIG    1        0.227  -0.572  -0.864  0.00  0.00    +0.087 C 
ATOM      6  C   LIG    1        1.690  -0.599  -1.304  0.00  0.00    +0.040 C 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        2.156  -2.618   1.310  0.00  0.00    +0.086 C 
ATOM      8  C   LIG    1        3.458  -1.978   1.000  0.00  0.00    +0.108 A 
ATOM      9  N   LIG    1        3.636  -0.797   0.303  0.00  0.00    -0.325 N 
ATOM     10  C   LIG    1        4.998  -0.544   0.254  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1        5.574  -1.621   0.918  0.00  0.00    +0.089 A 
ATOM     12  C   LIG    1        6.969  -1.695   1.052  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        7.755  -0.671   0.514  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1        7.162   0.406  -0.145  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        5.772   0.493  -0.289  0.00  0.00    +0.028 A 
ATOM     16  N   LIG    1        4.617  -2.490   1.363  0.00  0.00    -0.233 NA
ENDBRANCH   1   9
BRANCH   4  17
ATOM     17  C   LIG    1       -0.969   1.404  -1.648  0.00  0.00    +0.162 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.702   2.641  -1.262  0.00  0.00    +0.165 A 
ATOM     19  N   LIG    1       -2.806   2.686  -0.456  0.00  0.00    -0.228 N 
ATOM     20  N   LIG    1       -3.229   3.956  -0.335  0.00  0.00    -0.044 NA
ATOM     21  N   LIG    1       -2.378   4.675  -1.051  0.00  0.00    -0.023 NA
ATOM     22  N   LIG    1       -1.425   3.877  -1.633  0.00  0.00    -0.112 NA
BRANCH  19  23
ATOM     23  C   LIG    1       -3.514   1.617   0.207  0.00  0.00    +0.152 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.649   1.074  -0.656  0.00  0.00    +0.058 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -5.345  -0.081   0.017  0.00  0.00    -0.046 A 
ATOM     26  C   LIG    1       -4.894  -1.394  -0.177  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -5.524  -2.459   0.468  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -6.606  -2.222   1.313  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.059  -0.920   1.516  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.431   0.147   0.873  0.00  0.00    +0.004 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  19  23
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 6