REMARK  Name = BDB032518
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.009   1.804   2.087  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -1.389   1.347   0.481  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1       -1.249   1.862  -0.756  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1       -0.035   2.361  -1.069  0.00  0.00    +0.115 A 
ATOM      5  C   LIG    1        1.046   2.366  -0.202  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1        0.892   1.811   1.072  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1       -0.366   1.303   1.417  0.00  0.00    +0.072 A 
BRANCH   2   8
ATOM      8  O   LIG    1       -2.596   0.812   0.884  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1       -3.651   0.901  -0.080  0.00  0.00    +0.234 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -7.408  -1.948  -0.026  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -6.160  -1.258  -0.338  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -5.021  -1.890   0.347  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -3.673  -1.639  -0.343  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1       -3.627  -0.286  -1.064  0.00  0.00    +0.029 C 
ATOM     15  C   LIG    1       -4.787  -0.187  -2.074  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1       -5.942  -1.155  -1.779  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   6
BRANCH   1  17
ATOM     17  N   LIG    1        3.335   1.709   1.478  0.00  0.00    -0.339 N 
ATOM     18  H   LIG    1        4.019   2.222   2.030  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        3.880   0.487   1.039  0.00  0.00    +0.036 A 
ATOM     20  C   LIG    1        5.231   0.451   0.557  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        5.794  -0.768   0.098  0.00  0.00    +0.059 A 
ATOM     22  C   LIG    1        7.141  -0.766  -0.342  0.00  0.00    +0.127 A 
ATOM     23  N   LIG    1        7.906   0.339  -0.362  0.00  0.00    -0.240 NA
ATOM     24  C   LIG    1        7.351   1.490   0.046  0.00  0.00    +0.113 A 
ATOM     25  C   LIG    1        4.979  -1.915   0.093  0.00  0.00    +0.134 A 
ATOM     26  F   LIG    1        5.461  -3.094  -0.333  0.00  0.00    -0.205 F 
ATOM     27  C   LIG    1        3.655  -1.877   0.503  0.00  0.00    +0.041 A 
ATOM     28  C   LIG    1        6.050   1.595   0.502  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1        3.109  -0.683   0.960  0.00  0.00    +0.026 A 
BRANCH  22  30
ATOM     30  N   LIG    1        7.771  -1.934  -0.804  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1        7.241  -2.299  -1.592  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1        7.722  -2.642  -0.077  0.00  0.00    +0.144 HD
ENDBRANCH  22  30
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7