REMARK VINA RESULT: -4.6 1.831 6.136 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 11.787 3.316 -8.259 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 12.669 2.087 -8.341 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 13.945 2.155 -8.921 0.00 0.00 0.010 A ATOM 4 C UNL d 1 14.737 1.008 -9.043 0.00 0.00 0.037 A ATOM 5 C UNL d 1 14.248 -0.212 -8.590 0.00 0.00 0.065 A ATOM 6 C UNL d 1 12.994 -0.300 -8.003 0.00 0.00 0.037 A ATOM 7 C UNL d 1 12.206 0.846 -7.874 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 14.975 -1.359 -8.706 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 15.782 -1.164 -9.213 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 11.255 3.761 -9.604 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 10.423 2.917 -10.358 0.00 0.00 0.010 A ATOM 12 C UNL d 1 10.006 3.284 -11.640 0.00 0.00 0.037 A ATOM 13 C UNL d 1 10.410 4.504 -12.169 0.00 0.00 0.065 A ATOM 14 C UNL d 1 11.199 5.373 -11.425 0.00 0.00 0.037 A ATOM 15 C UNL d 1 11.625 5.001 -10.148 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 10.049 4.887 -13.428 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 10.331 5.807 -13.559 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4