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	hartrees
Energy at 0K	-702.219914
Energy at 298.15K	-702.227789
HF Energy	-701.234887
Nuclear repulsion energy	344.382262

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3275	3067	7.29
2	A	3275	3067	9.77
3	A	3223	3018	30.39
4	A	3222	3018	10.78
5	A	3122	2924	11.34
6	A	3121	2923	68.60
7	A	1568	1468	5.04
8	A	1567	1467	17.82
9	A	1550	1452	9.98
10	A	1550	1451	0.80
11	A	1513	1417	0.28
12	A	1508	1413	8.75
13	A	1261	1181	138.12
14	A	1217	1140	3.56
15	A	1209	1132	15.14
16	A	1202	1125	3.39
17	A	1199	1122	0.06
18	A	1080	1011	0.17
19	A	1035	970	345.71
20	A	769	720	122.92
21	A	705	660	225.93
22	A	510	477	28.55
23	A	436	408	0.70
24	A	398	373	0.00
25	A	275	257	8.14
26	A	190	178	3.85
27	A	159	149	0.72
28	A	158	148	0.66
29	A	72	68	3.48
30	A	67	63	10.68

Atom	x (Å)	y (Å)	z (Å)
S1	-0.000	0.237	0.436
O2	0.001	1.490	-0.339
O3	1.158	-0.793	-0.170
O4	-1.158	-0.792	-0.172
C5	2.476	-0.209	-0.089
C6	-2.476	-0.209	-0.089
H7	3.146	-0.978	-0.456
H8	-3.147	-0.979	-0.454
H9	2.544	0.679	-0.714
H10	2.738	0.042	0.941
H11	-2.736	0.042	0.941
H12	-2.545	0.678	-0.714

	S1	O2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.4731	1.6642	1.6640	2.5702	2.5700	3.4889	3.4887	2.8264	2.7910	2.7893	2.8277
O2	1.4731		2.5648	2.5647	3.0125	3.0141	3.9998	4.0018	2.6952	3.3505	3.3506	2.6985
O3	1.6642	2.5648		2.3167	1.4436	3.6822	2.0171	4.3187	2.0931	2.1037	4.1355	4.0223
O4	1.6640	2.5647	2.3167		3.6819	1.4436	4.3182	2.0172	4.0203	4.1369	2.1037	2.0930
C5	2.5702	3.0125	1.4436	3.6819		4.9525	1.0842	5.6873	1.0880	1.0914	5.3193	5.1376
C6	2.5700	3.0141	3.6822	1.4436	4.9525		5.6871	1.0843	5.1362	5.3208	1.0914	1.0880
H7	3.4889	3.9998	2.0171	4.3182	1.0842	5.6871		6.2935	1.7819	1.7770	6.1321	5.9337
H8	3.4887	4.0018	4.3187	2.0172	5.6873	1.0843	6.2935		5.9329	6.1333	1.7770	1.7820
H9	2.8264	2.6952	2.0931	4.0203	1.0880	5.1362	1.7819	5.9329		1.7836	5.5700	5.0892
H10	2.7910	3.3505	2.1037	4.1369	1.0914	5.3208	1.7770	6.1333	1.7836		5.4743	5.5729
H11	2.7893	3.3506	4.1355	2.1037	5.3193	1.0914	6.1321	1.7770	5.5700	5.4743		1.7836
H12	2.8277	2.6985	4.0223	2.0930	5.1376	1.0880	5.9337	1.7820	5.0892	5.5729	1.7836

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	O3	C5	111.393	S1	O4	C6	111.386
O2	S1	O3	109.523	O2	S1	O4	109.526
O3	S1	O4	88.227	O3	C5	H7	104.980
O3	C5	H9	110.753	O3	C5	H10	111.409
O4	C6	H8	104.983	O4	C6	H11	111.410
O4	C6	H12	110.746	H7	C5	H9	110.228
H7	C5	H10	109.523	H8	C6	H11	109.520
H8	C6	H12	110.236	H9	C5	H10	109.848
H11	C6	H12	109.847

All results from a given calculation for C₂H₆O₃S (Sulfurous acid, dimethyl ester)

using model chemistry: MP2/6-31G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for C2H6O3S (Sulfurous acid, dimethyl ester)

using model chemistry: MP2/6-31G**

States and conformations

All results from a given calculation for C₂H₆O₃S (Sulfurous acid, dimethyl ester)