REMARK  Name = BDB035030
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.484  -0.740  -1.636  0.00  0.00    +0.073 A 
ATOM      2  C   LIG    1       -2.409  -0.310  -0.647  0.00  0.00    +0.106 A 
ATOM      3  C   LIG    1       -1.887   0.838  -0.059  0.00  0.00    +0.067 A 
ATOM      4  C   LIG    1       -2.565   1.502   0.960  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1       -3.793   0.952   1.347  0.00  0.00    -0.009 A 
ATOM      6  C   LIG    1       -4.245  -0.213   0.712  0.00  0.00    +0.120 A 
ATOM      7  C   LIG    1       -4.598   1.619   2.424  0.00  0.00    +0.047 C 
ATOM      8  N   LIG    1       -0.688   1.098  -0.673  0.00  0.00    -0.354 N 
ATOM      9  H   LIG    1       -0.053   1.855  -0.438  0.00  0.00    +0.166 HD
ATOM     10  N   LIG    1       -3.593  -0.852  -0.273  0.00  0.00    -0.229 NA
ATOM     11  C   LIG    1       -0.423   0.146  -1.636  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   6  12
ATOM     12  N   LIG    1       -5.467  -0.793   1.073  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -5.556  -1.633   0.506  0.00  0.00    +0.144 HD
ATOM     14  H   LIG    1       -5.483  -1.010   2.062  0.00  0.00    +0.144 HD
ENDBRANCH   6  12
BRANCH   1  16
ATOM     15  C   LIG    1       -1.704  -2.837  -3.203  0.00  0.00    +0.009 C 
ATOM     16  C   LIG    1       -1.603  -1.879  -2.486  0.00  0.00    -0.066 C 
ENDBRANCH   1  16
BRANCH  11  17
ATOM     17  C   LIG    1        0.822   0.217  -2.440  0.00  0.00    +0.159 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.930  -0.172  -1.600  0.00  0.00    -0.306 N 
ATOM     19  H   LIG    1        2.047  -1.163  -1.438  0.00  0.00    +0.149 HD
ATOM     20  C   LIG    1        2.528   0.720  -0.735  0.00  0.00    +0.244 C 
ATOM     21  O   LIG    1        2.174   1.891  -0.630  0.00  0.00    -0.270 OA
BRANCH  20  22
ATOM     22  C   LIG    1        3.606   0.176   0.137  0.00  0.00    +0.037 A 
ATOM     23  C   LIG    1        3.859   0.812   1.359  0.00  0.00    +0.013 A 
ATOM     24  C   LIG    1        4.861   0.334   2.206  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        5.618  -0.776   1.832  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.382  -1.404   0.609  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        4.380  -0.929  -0.241  0.00  0.00    +0.013 A 
ENDBRANCH  20  22
ENDBRANCH  17  18
ENDBRANCH  11  17
TORSDOF 5