REMARK  Name = BDB016483
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.690  -0.423   5.100  0.00  0.00    +0.049 C 
ATOM      2  C   LIG    1       -1.387  -0.562   3.785  0.00  0.00    +0.007 A 
ATOM      3  C   LIG    1       -0.784  -0.273   2.567  0.00  0.00    +0.125 A 
ATOM      4  N   LIG    1       -1.457  -0.374   1.408  0.00  0.00    -0.213 NA
ATOM      5  C   LIG    1       -2.735  -0.792   1.456  0.00  0.00    +0.162 A 
ATOM      6  N   LIG    1       -3.387  -1.137   2.579  0.00  0.00    -0.235 NA
ATOM      7  C   LIG    1       -2.696  -0.999   3.721  0.00  0.00    +0.120 A 
ENDROOT
BRANCH   5   8
ATOM      8  C   LIG    1       -3.452  -0.963   0.180  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -3.556   0.047  -0.813  0.00  0.00    -0.034 A 
ATOM     10  C   LIG    1       -4.222  -0.252  -2.022  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -4.802  -1.500  -2.247  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -4.731  -2.480  -1.268  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.064  -2.212  -0.072  0.00  0.00    +0.012 A 
BRANCH   9  14
ATOM     14  C   LIG    1       -2.982   1.449  -0.615  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -1.775   1.676  -1.528  0.00  0.00    +0.012 C 
ATOM     16  C   LIG    1       -4.035   2.545  -0.825  0.00  0.00    +0.012 C 
ENDBRANCH   9  14
ENDBRANCH   5   8
BRANCH   3  17
ATOM     17  N   LIG    1        0.545   0.183   2.554  0.00  0.00    -0.328 N 
ATOM     18  H   LIG    1        1.130  -0.420   3.121  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.134   0.486   1.247  0.00  0.00    +0.108 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.553  -0.781   0.483  0.00  0.00    +0.025 C 
ATOM     21  C   LIG    1        2.005  -0.432  -0.940  0.00  0.00    +0.110 C 
ATOM     22  N   LIG    1        3.433  -0.146  -0.802  0.00  0.00    -0.328 N 
ATOM     23  C   LIG    1        3.965  -0.658   0.457  0.00  0.00    +0.105 C 
ATOM     24  C   LIG    1        2.804  -1.449   1.059  0.00  0.00    +0.025 C 
BRANCH  22  25
ATOM     25  C   LIG    1        4.212   0.358  -1.816  0.00  0.00    +0.048 A 
ATOM     26  C   LIG    1        3.724   0.641  -3.098  0.00  0.00    +0.133 A 
ATOM     27  N   LIG    1        4.441   1.146  -4.138  0.00  0.00    -0.261 NA
ATOM     28  C   LIG    1        5.740   1.399  -3.900  0.00  0.00    +0.111 A 
ATOM     29  C   LIG    1        6.345   1.171  -2.679  0.00  0.00    +0.021 A 
ATOM     30  C   LIG    1        5.570   0.651  -1.639  0.00  0.00    +0.026 A 
ENDBRANCH  22  25
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 6