REMARK VINA RESULT:       3.0      1.269      1.444
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      20.702   7.990 -11.394  0.00  0.00    -0.337 OA
ATOM      2  C   UNL d   1      20.896   9.361 -10.944  0.00  0.00     0.065 C 
ATOM      3  C   UNL d   1      22.351   9.536 -10.452  0.00  0.00     0.079 C 
ATOM      4  C   UNL d   1      22.799   8.126 -10.445  0.00  0.00    -0.019 A 
ATOM      5  C   UNL d   1      21.826   7.311 -11.000  0.00  0.00     0.110 A 
ATOM      6  C   UNL d   1      19.890   9.624  -9.819  0.00  0.00     0.046 C 
ATOM      7  C   UNL d   1      20.602  10.279 -12.134  0.00  0.00     0.046 C 
ATOM      8  C   UNL d   1      24.009   7.604 -10.016  0.00  0.00     0.010 A 
ATOM      9  C   UNL d   1      22.021   5.947 -11.138  0.00  0.00     0.114 A 
ATOM     10  C   UNL d   1      24.226   6.233 -10.162  0.00  0.00     0.003 A 
ATOM     11  C   UNL d   1      23.243   5.406 -10.732  0.00  0.00     0.040 A 
ENDROOT
BRANCH   9  12
ATOM     12  O   UNL d   1      20.999   5.196 -11.753  0.00  0.00    -0.259 OA
BRANCH  12  13
ATOM     13  C   UNL d   1      21.233   3.920 -12.251  0.00  0.00     0.365 C 
ATOM     14  O   UNL d   1      21.826   3.014 -11.678  0.00  0.00    -0.238 OA
ATOM     15  N   UNL d   1      20.731   3.720 -13.508  0.00  0.00    -0.341 N 
ATOM     16  C   UNL d   1      19.965   4.648 -14.301  0.00  0.00     0.151 C 
ATOM     17  H   UNL d   1      20.916   2.795 -13.874  0.00  0.00     0.164 HD
ENDBRANCH  12  13
ENDBRANCH   9  12
TORSDOF 2