REMARK  Name = BDB027830
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.304   1.003  -0.120  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1       -0.244   2.317  -0.156  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1       -1.637   2.450  -0.304  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1       -2.138   3.743  -0.357  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -1.415   4.889  -0.267  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.093   4.736  -0.098  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -2.473   1.401  -0.387  0.00  0.00    -0.245 NA
ATOM      8  C   LIG    1       -1.964   0.152  -0.290  0.00  0.00    +0.076 A 
ATOM      9  C   LIG    1        0.527   3.498  -0.037  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1       -0.594  -0.065  -0.160  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -2.958  -0.936  -0.363  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1       -2.801  -2.159   0.298  0.00  0.00    +0.151 A 
ATOM     13  F   LIG    1       -1.728  -2.412   1.062  0.00  0.00    -0.203 F 
ATOM     14  C   LIG    1       -3.780  -3.135   0.182  0.00  0.00    +0.149 A 
ATOM     15  N   LIG    1       -4.910  -2.990  -0.544  0.00  0.00    -0.260 NA
ATOM     16  C   LIG    1       -5.066  -1.806  -1.171  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1       -4.139  -0.774  -1.110  0.00  0.00    +0.032 A 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  N   LIG    1        1.684   0.846   0.022  0.00  0.00    -0.338 N 
ATOM     19  H   LIG    1        2.172   1.521  -0.565  0.00  0.00    +0.147 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.491  -0.380   0.213  0.00  0.00    +0.026 C 
ATOM     21  C   LIG    1        2.413  -1.286  -1.025  0.00  0.00    +0.031 C 
ATOM     22  C   LIG    1        3.958   0.112   0.327  0.00  0.00    +0.031 C 
BRANCH  20  24
ATOM     23  C   LIG    1        2.903  -2.340   1.875  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1        2.100  -1.089   1.536  0.00  0.00    +0.022 C 
ENDBRANCH  20  24
ENDBRANCH  18  20
ENDBRANCH   1  18
TORSDOF 4