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	hartrees
Energy at 0K	-982.932674
Energy at 298.15K	-982.938562
HF Energy	-981.983459
Nuclear repulsion energy	335.683590

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3683	3541
2	A_g	3514	3379
3	A_g	1661	1598
4	A_g	1459	1403
5	A_g	1344	1292
6	A_g	963	926
7	A_g	676	650
8	A_g	426	410
9	A_g	341	328
10	A_u	648	623
11	A_u	462	444
12	A_u	384	369
13	A_u	22	21
14	B_g	701	674
15	B_g	643	618
16	B_g	430	413
17	B_u	3685	3543
18	B_u	3519	3384
19	B_u	1626	1563
20	B_u	1447	1392
21	B_u	1245	1197
22	B_u	882	848
23	B_u	463	445
24	B_u	288	277

Atom	x (Å)	y (Å)
C1	-0.043	0.766
C2	0.043	-0.766
S3	1.302	1.753
S4	-1.302	-1.753
N5	-1.302	1.223
N6	1.302	-1.223
H7	-2.076	0.560
H8	-1.471	2.222
H9	2.076	-0.560
H10	1.471	-2.222

	C1	C2	S3	S4	N5	N6	H7	H8	H9	H10
C1		1.5346	1.6679	2.8162	1.3397	2.4008	2.0434	2.0400	2.4990	3.3500
C2	1.5346		2.8162	1.6679	2.4008	1.3397	2.4990	3.3500	2.0434	2.0400
S3	1.6679	2.8162		4.3669	2.6576	2.9754	3.5822	2.8130	2.4384	3.9785
S4	2.8162	1.6679	4.3669		2.9754	2.6576	2.4384	3.9785	3.5822	2.8130
N5	1.3397	2.4008	2.6576	2.9754		3.5724	1.0187	1.0137	3.8192	4.4226
N6	2.4008	1.3397	2.9754	2.6576	3.5724		3.8192	4.4226	1.0187	1.0137
H7	2.0434	2.4990	3.5822	2.4384	1.0187	3.8192		1.7687	4.2996	4.5079
H8	2.0400	3.3500	2.8130	3.9785	1.0137	4.4226	1.7687		4.5079	5.3303
H9	2.4990	2.0434	2.4384	3.5822	3.8192	1.0187	4.2996	4.5079		1.7687
H10	3.3500	2.0400	3.9785	2.8130	4.4226	1.0137	4.5079	5.3303	1.7687

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S4	123.080	C1	C2	N6	113.113
C1	N5	H7	119.476	C1	N5	H8	119.545
C2	C1	S3	123.080	C2	C1	N5	113.113
C2	N6	H9	119.476	C2	N6	H10	119.545
S3	C1	N5	123.807	S4	C2	N6	123.807
H7	N5	H8	120.979	H9	N6	H10	120.979

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)

using model chemistry: MP4=FULL/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 C2H4N2S2 (Ethanedithioamide)

using model chemistry: MP4=FULL/6-31G*

States and conformations

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)