REMARK VINA RESULT:      -4.1      1.167      1.582
REMARK  2 active torsions:
REMARK  status: ('A' for Active; 'I' for Inactive)
REMARK    1  A    between atoms: O_2  and  C_12 
REMARK    2  A    between atoms: O_2  and  C_15 
REMARK       I    between atoms: N_4  and  C_15 
ROOT
ATOM      1  O   UNL d   1      45.939  63.173  56.764  0.00  0.00    -0.337 OA
ATOM      2  C   UNL d   1      46.254  63.565  55.397  0.00  0.00     0.065 C 
ATOM      3  C   UNL d   1      45.254  64.650  54.934  0.00  0.00     0.079 C 
ATOM      4  C   UNL d   1      44.276  64.600  56.044  0.00  0.00    -0.019 A 
ATOM      5  C   UNL d   1      44.731  63.757  57.046  0.00  0.00     0.110 A 
ATOM      6  C   UNL d   1      46.160  62.310  54.524  0.00  0.00     0.046 C 
ATOM      7  C   UNL d   1      47.688  64.099  55.393  0.00  0.00     0.046 C 
ATOM      8  C   UNL d   1      43.083  65.290  56.178  0.00  0.00     0.010 A 
ATOM      9  C   UNL d   1      44.007  63.566  58.210  0.00  0.00     0.114 A 
ATOM     10  C   UNL d   1      42.348  65.120  57.354  0.00  0.00     0.003 A 
ATOM     11  C   UNL d   1      42.812  64.271  58.373  0.00  0.00     0.040 A 
ENDROOT
BRANCH   9  12
ATOM     12  O   UNL d   1      44.561  62.727  59.198  0.00  0.00    -0.259 OA
BRANCH  12  13
ATOM     13  C   UNL d   1      45.008  63.230  60.414  0.00  0.00     0.365 C 
ATOM     14  O   UNL d   1      44.335  63.834  61.241  0.00  0.00    -0.238 OA
ATOM     15  N   UNL d   1      46.336  63.001  60.649  0.00  0.00    -0.341 N 
ATOM     16  C   UNL d   1      47.256  62.266  59.819  0.00  0.00     0.151 C 
ATOM     17  H   UNL d   1      46.662  63.381  61.528  0.00  0.00     0.164 HD
ENDBRANCH  12  13
ENDBRANCH   9  12
TORSDOF 2