REMARK  Name = BDB062143
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.925  -0.459   1.729  0.00  0.00    +0.097 A 
ATOM      2  C   LIG    1        0.462  -0.515   1.643  0.00  0.00    +0.077 A 
ATOM      3  N   LIG    1        0.869  -0.548   2.961  0.00  0.00    -0.333 N 
ATOM      4  C   LIG    1        2.229  -0.586   3.441  0.00  0.00    +0.150 C 
ATOM      5  C   LIG    1       -0.242  -0.514   3.753  0.00  0.00    +0.200 A 
ATOM      6  N   LIG    1       -1.341  -0.452   3.041  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1        1.379  -0.531   0.498  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1        1.771   0.653  -0.186  0.00  0.00    -0.007 A 
ATOM      9  C   LIG    1        2.646   0.555  -1.304  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        3.018   1.745  -1.979  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1        2.559   2.997  -1.571  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        1.718   3.095  -0.476  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        3.115  -0.725  -1.696  0.00  0.00    +0.059 A 
ATOM     14  C   LIG    1        2.736  -1.875  -0.995  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        1.334   1.940   0.205  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        1.880  -1.776   0.095  0.00  0.00    +0.012 A 
BRANCH  13  17
ATOM     17  C   LIG    1        4.000  -0.894  -2.817  0.00  0.00    +0.100 C 
ATOM     18  N   LIG    1        4.718  -1.039  -3.717  0.00  0.00    -0.191 NA
ENDBRANCH  13  17
ENDBRANCH   2   7
BRANCH   1  21
ATOM     19  C   LIG    1       -2.509   1.993   1.366  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1       -2.569   0.839   0.400  0.00  0.00    -0.039 A 
ATOM     21  C   LIG    1       -1.857  -0.364   0.614  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -2.095  -1.465  -0.237  0.00  0.00    -0.039 A 
ATOM     23  C   LIG    1       -1.492  -2.827  -0.021  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1       -2.948  -1.308  -1.346  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1       -3.576  -0.095  -1.621  0.00  0.00    +0.025 A 
ATOM     26  C   LIG    1       -3.435   0.945  -0.704  0.00  0.00    +0.026 A 
BRANCH  25  27
ATOM     27  N   LIG    1       -4.513  -0.003  -2.657  0.00  0.00    -0.358 N 
ATOM     28  H   LIG    1       -4.332  -0.638  -3.428  0.00  0.00    +0.142 HD
ATOM     29  H   LIG    1       -4.677   0.948  -2.973  0.00  0.00    +0.142 HD
ENDBRANCH  25  27
ENDBRANCH   1  21
TORSDOF 4