REMARK  Name = BDB007088
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.721   0.597   0.674  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.220   1.783   0.117  0.00  0.00    +0.023 A 
ATOM      3  C   LIG    1       -0.982   1.753  -0.617  0.00  0.00    +0.001 A 
ATOM      4  C   LIG    1       -1.732   2.745  -1.304  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -2.834   2.132  -1.853  0.00  0.00    +0.087 A 
ATOM      6  N   LIG    1       -2.796   0.803  -1.506  0.00  0.00    -0.342 N 
ATOM      7  C   LIG    1       -1.660   0.539  -0.763  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1       -1.177  -0.653  -0.200  0.00  0.00    +0.027 A 
ATOM      9  C   LIG    1        0.020  -0.603   0.524  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  11
ATOM     10  O   LIG    1        2.324   1.712   1.994  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        1.997   0.669   1.439  0.00  0.00    +0.244 C 
ATOM     12  N   LIG    1        2.770  -0.473   1.441  0.00  0.00    -0.307 N 
ATOM     13  H   LIG    1        2.565  -1.195   0.765  0.00  0.00    +0.149 HD
BRANCH  12  14
ATOM     14  C   LIG    1        4.097  -0.484   2.014  0.00  0.00    +0.139 C 
BRANCH  14  15
ATOM     15  C   LIG    1        5.145  -0.367   0.938  0.00  0.00    -0.030 A 
ATOM     16  C   LIG    1        5.446   0.884   0.379  0.00  0.00    +0.005 A 
ATOM     17  C   LIG    1        6.400   0.998  -0.632  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        7.059  -0.137  -1.100  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        6.763  -1.387  -0.558  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.809  -1.503   0.454  0.00  0.00    +0.005 A 
ENDBRANCH  14  15
ENDBRANCH  12  14
ENDBRANCH   1  11
BRANCH   6  21
ATOM     21  C   LIG    1       -3.798  -0.178  -1.913  0.00  0.00    +0.159 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.751  -0.511  -0.794  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1       -4.821  -1.818  -0.296  0.00  0.00    +0.131 A 
ATOM     24  F   LIG    1       -4.032  -2.770  -0.813  0.00  0.00    -0.205 F 
ATOM     25  C   LIG    1       -5.694  -2.161   0.730  0.00  0.00    +0.077 A 
ATOM     26  C   LIG    1       -6.516  -1.182   1.266  0.00  0.00    +0.126 A 
ATOM     27  F   LIG    1       -7.362  -1.500   2.254  0.00  0.00    -0.205 F 
ATOM     28  C   LIG    1       -6.477   0.126   0.793  0.00  0.00    +0.039 A 
ATOM     29  C   LIG    1       -5.598   0.462  -0.239  0.00  0.00    +0.011 A 
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5