REMARK  Name = BDB014363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.119  -3.029   0.475  0.00  0.00    +0.270 C 
ATOM      2  N   LIG    1        0.624  -2.014  -0.093  0.00  0.00    -0.274 N 
ATOM      3  H   LIG    1        0.149  -1.427  -0.775  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.355  -3.991   1.071  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        1.974  -1.805  -0.044  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        2.587  -0.824  -0.985  0.00  0.00    +0.289 A 
ATOM      7  O   LIG    1        1.923  -0.108  -1.722  0.00  0.00    -0.264 OA
ATOM      8  N   LIG    1        3.972  -0.827  -0.774  0.00  0.00    -0.245 N 
ATOM      9  N   LIG    1        4.234  -1.711   0.325  0.00  0.00    -0.287 N 
ATOM     10  C   LIG    1        5.324  -2.668   0.069  0.00  0.00    +0.170 C 
ATOM     11  C   LIG    1        2.987  -2.240   0.721  0.00  0.00    +0.059 A 
ATOM     12  C   LIG    1        2.925  -3.126   1.924  0.00  0.00    +0.067 C 
BRANCH   8  13
ATOM     13  C   LIG    1        4.667   0.461  -0.848  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1        6.186   0.355  -1.000  0.00  0.00    +0.027 C 
ATOM     15  C   LIG    1        6.812   1.715  -1.326  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1        6.063   2.897  -0.705  0.00  0.00    +0.000 C 
ATOM     17  C   LIG    1        5.333   2.501   0.571  0.00  0.00    +0.002 C 
ATOM     18  C   LIG    1        4.297   1.401   0.321  0.00  0.00    +0.027 C 
ENDBRANCH   8  13
ENDBRANCH   2   5
BRANCH   1  24
ATOM     19  C   LIG    1       -2.026  -0.331   0.643  0.00  0.00    +0.050 C 
ATOM     20  C   LIG    1       -2.390  -1.718   0.274  0.00  0.00    +0.029 A 
ATOM     21  C   LIG    1       -3.642  -2.180  -0.092  0.00  0.00    +0.196 A 
ATOM     22  O   LIG    1       -3.578  -3.523  -0.293  0.00  0.00    -0.353 OA
ATOM     23  N   LIG    1       -2.297  -3.972  -0.073  0.00  0.00    -0.073 NA
ATOM     24  C   LIG    1       -1.565  -2.891   0.236  0.00  0.00    +0.171 A 
BRANCH  21  25
ATOM     25  C   LIG    1       -4.980  -1.585  -0.312  0.00  0.00    +0.322 C 
ATOM     26  O   LIG    1       -5.153  -0.430   0.526  0.00  0.00    -0.339 OA
ATOM     27  C   LIG    1       -5.922   0.454  -0.302  0.00  0.00    +0.153 C 
ATOM     28  C   LIG    1       -5.298   0.219  -1.663  0.00  0.00    +0.195 C 
ATOM     29  O   LIG    1       -5.076  -1.194  -1.690  0.00  0.00    -0.342 OA
BRANCH  27  30
ATOM     30  C   LIG    1       -5.948   1.907   0.229  0.00  0.00    -0.009 C 
ATOM     31  C   LIG    1       -4.540   2.498   0.405  0.00  0.00    +0.013 C 
ATOM     32  C   LIG    1       -6.748   2.802  -0.733  0.00  0.00    +0.013 C 
ATOM     33  C   LIG    1       -6.642   1.921   1.607  0.00  0.00    +0.013 C 
ENDBRANCH  27  30
ENDBRANCH  21  25
ENDBRANCH   1  24
TORSDOF 5