REMARK  Name = BDB032484
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.635  -0.554   0.587  0.00  0.00    -0.024 A 
ATOM      2  C   LIG    1       -0.146   0.549   0.230  0.00  0.00    +0.072 A 
ATOM      3  C   LIG    1       -1.279   0.340  -0.542  0.00  0.00    +0.215 A 
ATOM      4  N   LIG    1       -1.681  -0.874  -0.970  0.00  0.00    -0.221 NA
ATOM      5  C   LIG    1       -0.911  -1.926  -0.621  0.00  0.00    +0.115 A 
ATOM      6  C   LIG    1        0.239  -1.819   0.143  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        1.887  -0.387   1.412  0.00  0.00    +0.137 C 
BRANCH   7   8
ATOM      8  N   LIG    1        3.043  -0.679   0.577  0.00  0.00    -0.339 N 
ATOM      9  H   LIG    1        2.961  -0.233  -0.334  0.00  0.00    +0.146 HD
BRANCH   8  13
ATOM     10  C   LIG    1        7.872  -0.647  -0.213  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1        6.793  -0.541   0.702  0.00  0.00    +0.023 A 
ATOM     12  C   LIG    1        5.472  -0.669   0.199  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        4.352  -0.538   1.083  0.00  0.00    +0.035 A 
ATOM     14  C   LIG    1        4.596  -0.380   2.456  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1        5.890  -0.261   2.953  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1        5.331  -0.933  -1.176  0.00  0.00    +0.030 A 
ATOM     17  C   LIG    1        6.453  -1.026  -1.978  0.00  0.00    +0.113 A 
ATOM     18  C   LIG    1        6.974  -0.328   2.085  0.00  0.00    +0.012 A 
ATOM     19  N   LIG    1        7.709  -0.879  -1.526  0.00  0.00    -0.240 NA
BRANCH  10  20
ATOM     20  N   LIG    1        9.206  -0.524   0.210  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1        9.337   0.383   0.645  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1        9.406  -1.249   0.892  0.00  0.00    +0.144 HD
ENDBRANCH  10  20
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   3  23
ATOM     23  O   LIG    1       -2.020   1.463  -0.850  0.00  0.00    -0.476 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -3.117   1.231  -1.738  0.00  0.00    +0.234 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.382   0.803  -0.980  0.00  0.00    +0.035 C 
ATOM     26  C   LIG    1       -5.525   0.537  -1.974  0.00  0.00    +0.081 C 
ATOM     27  C   LIG    1       -6.841   0.384  -1.289  0.00  0.00    +0.110 A 
ATOM     28  N   LIG    1       -7.048   0.815  -0.004  0.00  0.00    -0.334 N 
ATOM     29  C   LIG    1       -8.349   0.573   0.324  0.00  0.00    +0.107 A 
ATOM     30  C   LIG    1       -8.889  -0.005  -0.802  0.00  0.00    +0.130 A 
ATOM     31  C   LIG    1       -6.025   1.379   0.850  0.00  0.00    +0.123 C 
ATOM     32  N   LIG    1       -7.949  -0.115  -1.795  0.00  0.00    -0.241 NA
ATOM     33  C   LIG    1       -4.808   1.859   0.059  0.00  0.00    +0.029 C 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 7