REMARK  Name = BDB001479
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.374   3.144   0.344  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1       -1.463   2.214   0.154  0.00  0.00    -0.264 N 
ATOM      3  C   LIG    1       -1.390   0.885  -0.135  0.00  0.00    +0.092 A 
ATOM      4  C   LIG    1       -0.218   0.041  -0.266  0.00  0.00    +0.097 A 
ATOM      5  C   LIG    1       -0.408  -1.236  -0.754  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1       -1.747  -1.696  -1.264  0.00  0.00    +0.050 C 
ATOM      7  C   LIG    1       -3.011  -1.012  -0.604  0.00  0.00    -0.001 C 
ATOM      8  C   LIG    1       -3.374  -1.779   0.683  0.00  0.00    +0.016 C 
ATOM      9  C   LIG    1       -4.154  -1.155  -1.627  0.00  0.00    +0.016 C 
ATOM     10  C   LIG    1        0.734  -1.990  -0.829  0.00  0.00    +0.120 A 
ATOM     11  N   LIG    1        1.940  -1.542  -0.434  0.00  0.00    -0.222 NA
ATOM     12  C   LIG    1        2.021  -0.290   0.043  0.00  0.00    +0.220 A 
ATOM     13  N   LIG    1        0.964   0.533   0.139  0.00  0.00    -0.212 NA
ATOM     14  C   LIG    1       -2.698   0.439  -0.268  0.00  0.00    +0.018 A 
ATOM     15  C   LIG    1       -3.503   1.573   0.059  0.00  0.00    +0.151 A 
ATOM     16  N   LIG    1       -2.728   2.664   0.264  0.00  0.00    -0.166 NA
ENDROOT
BRANCH  15  17
ATOM     17  C   LIG    1       -4.963   1.688   0.224  0.00  0.00    +0.262 C 
ATOM     18  O   LIG    1       -5.743   0.746   0.298  0.00  0.00    -0.269 OA
ATOM     19  N   LIG    1       -5.406   2.978   0.340  0.00  0.00    -0.324 N 
ATOM     20  H   LIG    1       -4.698   3.693   0.470  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1       -6.354   3.133   0.646  0.00  0.00    +0.145 HD
ENDBRANCH  15  17
BRANCH  12  22
ATOM     22  N   LIG    1        3.225   0.257   0.480  0.00  0.00    -0.284 N 
ATOM     23  H   LIG    1        3.058   1.192   0.819  0.00  0.00    +0.155 HD
BRANCH  22  24
ATOM     24  C   LIG    1        4.536  -0.221   0.575  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        4.933  -1.502   0.177  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        6.264  -1.919   0.294  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        7.226  -1.057   0.812  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.856   0.223   1.212  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        5.525   0.633   1.093  0.00  0.00    +0.023 A 
ENDBRANCH  22  24
ENDBRANCH  12  22
TORSDOF 3