REMARK REMARK TITLE Acetic_acid REMARK CHARGE-VALUE 0 REMARK MULTIPLICITY-VALUE 1 REMARK REMARK REORIENT 1 5 6 | 6 5 1 | 5 6 7 | 7 6 5 REMARK ATOM 1 CT1 ACH 1 -1.387 -0.123 0.000 C1 ATOM 2 H1 ACH 1 -1.910 0.821 -0.000 H11 ATOM 3 H1 ACH 1 -1.660 -0.701 0.875 H12 ATOM 4 H1 ACH 1 -1.660 -0.701 -0.875 H13 ATOM 5 C2 ACH 1 0.095 0.123 0.000 C2 ATOM 6 O3 ACH 1 0.622 1.187 0.000 O3 ATOM 7 O4 ACH 1 0.786 -1.015 0.000 O4 ATOM 8 H4 ACH 1 1.714 -0.798 0.000 H4 CONECT 1 2 3 4 5 CONECT 2 1 CONECT 3 1 CONECT 4 1 CONECT 5 1 6 7 CONECT 6 5 CONECT 7 5 8 CONECT 8 7 END