REMARK  Name = BDB032382
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.758   1.732  -0.834  0.00  0.00    -0.019 A 
ATOM      2  C   LIG    1       -1.139   2.109   0.365  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1        0.099   1.577   0.714  0.00  0.00    +0.128 A 
ATOM      4  F   LIG    1        0.653   1.947   1.878  0.00  0.00    -0.205 F 
ATOM      5  C   LIG    1        0.764   0.675  -0.118  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        0.143   0.296  -1.318  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1       -1.101   0.826  -1.676  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1       -3.092   2.319  -1.229  0.00  0.00    +0.195 C 
BRANCH   8   9
ATOM      9  O   LIG    1       -3.992   2.362  -0.121  0.00  0.00    -0.372 OA
BRANCH   9  14
ATOM     10  C   LIG    1       -7.556  -1.705   1.289  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -6.486  -0.786   0.907  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -6.706  -0.259  -0.448  0.00  0.00    +0.086 C 
ATOM     13  C   LIG    1       -5.941   1.039  -0.730  0.00  0.00    +0.047 C 
ATOM     14  C   LIG    1       -4.676   1.126   0.119  0.00  0.00    +0.121 C 
ATOM     15  C   LIG    1       -5.038   1.073   1.608  0.00  0.00    +0.047 C 
ATOM     16  C   LIG    1       -6.324   0.289   1.885  0.00  0.00    +0.086 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   1   8
BRANCH   5  17
ATOM     17  C   LIG    1        2.091   0.089   0.293  0.00  0.00    +0.139 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.056   0.226  -0.795  0.00  0.00    -0.340 N 
ATOM     19  H   LIG    1        3.020   1.153  -1.214  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        4.376  -0.198  -0.609  0.00  0.00    +0.028 A 
ATOM     21  C   LIG    1        4.761  -1.163   0.330  0.00  0.00    +0.031 A 
ATOM     22  C   LIG    1        6.094  -1.613   0.434  0.00  0.00    -0.011 A 
ATOM     23  C   LIG    1        7.076  -1.107  -0.439  0.00  0.00    +0.022 A 
ATOM     24  C   LIG    1        8.396  -1.584  -0.283  0.00  0.00    +0.124 A 
ATOM     25  N   LIG    1        8.754  -2.505   0.632  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1        7.785  -2.976   1.441  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1        6.678  -0.174  -1.418  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1        6.464  -2.567   1.387  0.00  0.00    +0.028 A 
ATOM     29  C   LIG    1        5.350   0.258  -1.505  0.00  0.00    +0.023 A 
BRANCH  24  30
ATOM     30  N   LIG    1        9.445  -1.129  -1.090  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1        9.530  -0.122  -1.025  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1       10.282  -1.596  -0.749  0.00  0.00    +0.144 HD
ENDBRANCH  24  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   5  17
TORSDOF 7