REMARK  Name = BDB065242
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.650  -0.778   0.063  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -2.045  -0.609   0.189  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1       -2.727  -1.641   0.845  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -4.105  -1.550   0.992  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1       -4.832  -0.453   0.515  0.00  0.00    +0.164 A 
ATOM      6  C   LIG    1       -4.155   0.597  -0.124  0.00  0.00    +0.162 A 
ATOM      7  N   LIG    1       -2.107  -2.714   1.340  0.00  0.00    -0.218 NA
ATOM      8  C   LIG    1       -0.774  -2.761   1.189  0.00  0.00    +0.234 A 
ATOM      9  C   LIG    1       -2.771   0.513  -0.284  0.00  0.00    +0.062 A 
ATOM     10  N   LIG    1       -0.017  -1.844   0.571  0.00  0.00    -0.203 NA
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1        0.102   0.211  -0.609  0.00  0.00    -0.326 N 
ATOM     12  H   LIG    1       -0.290   0.311  -1.543  0.00  0.00    +0.148 HD
BRANCH  11  16
ATOM     13  N   LIG    1        4.311   0.434  -0.563  0.00  0.00    -0.302 NA
ATOM     14  C   LIG    1        3.587   0.973   0.588  0.00  0.00    +0.086 C 
ATOM     15  C   LIG    1        2.211   0.309   0.701  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1        1.565   0.018  -0.665  0.00  0.00    +0.074 C 
ATOM     17  C   LIG    1        2.140   0.966  -1.721  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1        3.661   0.820  -1.827  0.00  0.00    +0.086 C 
BRANCH  13  20
ATOM     19  C   LIG    1        6.544   0.099   0.498  0.00  0.00    +0.020 C 
ATOM     20  C   LIG    1        5.734   0.803  -0.584  0.00  0.00    +0.081 C 
ENDBRANCH  13  20
ENDBRANCH  11  16
ENDBRANCH   1  11
BRANCH   6  21
ATOM     21  O   LIG    1       -4.927   1.643  -0.558  0.00  0.00    -0.491 OA
ATOM     22  C   LIG    1       -4.265   2.778  -1.097  0.00  0.00    +0.277 C 
ENDBRANCH   6  21
BRANCH   5  23
ATOM     23  O   LIG    1       -6.192  -0.312   0.632  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1       -6.913  -1.352   1.278  0.00  0.00    +0.277 C 
ENDBRANCH   5  23
BRANCH   8  25
ATOM     25  C   LIG    1       -0.096  -3.909   1.732  0.00  0.00    +0.140 C 
ATOM     26  N   LIG    1        0.448  -4.839   2.171  0.00  0.00    -0.188 NA
ENDBRANCH   8  25
TORSDOF 6