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	hartrees
Energy at 0K	-1310.559748
Energy at 298.15K	-1310.566074
HF Energy	-1309.710257
Nuclear repulsion energy	432.735045

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3208	3048	4.27
2	A	3206	3047	0.00
3	A	3200	3041	2.90
4	A	3199	3040	4.47
5	A	3094	2940	7.87
6	A	3094	2940	8.52
7	A	1488	1414	1.01
8	A	1485	1411	27.37
9	A	1462	1389	0.00
10	A	1462	1389	20.32
11	A	1398	1329	0.10
12	A	1389	1320	1.51
13	A	1149	1092	172.24
14	A	1012	962	10.23
15	A	1006	956	15.47
16	A	1003	953	12.75
17	A	1000	950	0.00
18	A	865	822	177.28
19	A	773	734	1.78
20	A	761	723	2.32
21	A	528	502	2.64
22	A	486	462	4.25
23	A	366	348	4.49
24	A	317	301	2.55
25	A	256	243	3.31
26	A	212	201	0.03
27	A	212	201	0.02
28	A	196	186	1.51
29	A	87	82	5.47
30	A	49	46	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.020	-0.000
S2	0.000	1.656	0.000
S3	1.431	-1.001	0.000
S4	-1.432	-1.001	-0.000
C5	2.745	0.225	-0.000
C6	-2.745	0.225	0.000
H7	2.692	0.850	0.891
H8	-2.692	0.851	0.891
H9	3.676	-0.346	-0.000
H10	2.691	0.850	-0.891
H11	-2.692	0.851	-0.891
H12	-3.676	-0.346	-0.000

	C1	S2	S3	S4	C5	C6	H7	H8	H9	H10	H11	H12
C1		1.6363	1.7582	1.7582	2.7525	2.7526	2.9546	2.9545	3.6942	2.9542	2.9545	3.6943
S2	1.6363		3.0181	3.0183	3.0955	3.0957	2.9476	2.9477	4.1859	2.9473	2.9476	4.1861
S3	1.7582	3.0181		2.8629	1.7966	4.3525	2.4104	4.6067	2.3381	2.4103	4.6068	5.1493
S4	1.7582	3.0183	2.8629		4.3525	1.7966	4.6070	2.4104	5.1493	4.6065	2.4103	2.3381
C5	2.7525	3.0955	1.7966	4.3525		5.4897	1.0899	5.5445	1.0924	1.0899	5.5444	6.4462
C6	2.7526	3.0957	4.3525	1.7966	5.4897		5.5447	1.0899	6.4462	5.5443	1.0899	1.0924
H7	2.9546	2.9476	2.4104	4.6070	1.0899	5.5447		5.3836	1.7874	1.7819	5.6708	6.5404
H8	2.9545	2.9477	4.6067	2.4104	5.5445	1.0899	5.3836		6.5402	5.6704	1.7818	1.7874
H9	3.6942	4.1859	2.3381	5.1493	1.0924	6.4462	1.7874	6.5402		1.7874	6.5401	7.3520
H10	2.9542	2.9473	2.4103	4.6065	1.0899	5.5443	1.7819	5.6704	1.7874		5.3831	6.5399
H11	2.9545	2.9476	4.6068	2.4103	5.5444	1.0899	5.6708	1.7818	6.5401	5.3831		1.7874
H12	3.6943	4.1861	5.1493	2.3381	6.4462	1.0924	6.5404	1.7874	7.3520	6.5399	1.7874

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S3	C5	101.477	C1	S4	C6	101.479
S2	C1	S3	125.494	S2	C1	S4	125.498
S3	C1	S4	109.008	S3	C5	H7	110.854
S3	C5	H9	105.449	S3	C5	H10	110.852
S4	C6	H8	110.855	S4	C6	H11	110.851
S4	C6	H12	105.452	H7	C5	H9	109.976
H7	C5	H10	109.658	H8	C6	H11	109.654
H8	C6	H12	109.983	H9	C5	H10	109.982
H11	C6	H12	109.977

All results from a given calculation for C₃H₆S₃ (Carbonotrithioic acid, dimethyl ester)

using model chemistry: MP2/6-311G**

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 C3H6S3 (Carbonotrithioic acid, dimethyl ester)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for C₃H₆S₃ (Carbonotrithioic acid, dimethyl ester)