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	hartrees
Energy at 0K	-982.881157
Energy at 298.15K	-982.887225
HF Energy	-982.001962
Nuclear repulsion energy	337.637814

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3808	3571	0.00
2	A_g	3632	3406	0.00
3	A_g	1703	1597	0.00
4	A_g	1478	1386	0.00
5	A_g	1388	1301	0.00
6	A_g	999	936	0.00
7	A_g	696	653	0.00
8	A_g	431	404	0.00
9	A_g	347	325	0.00
10	A_u	660	618	3.64
11	A_u	510	478	396.52
12	A_u	397	372	40.60
13	A_u	14	14	7.84
14	B_g	718	673	0.00
15	B_g	654	614	0.00
16	B_g	486	456	0.00
17	B_u	3810	3572	197.35
18	B_u	3640	3413	272.48
19	B_u	1667	1563	547.12
20	B_u	1471	1380	475.09
21	B_u	1274	1195	126.68
22	B_u	909	853	83.99
23	B_u	475	445	0.35
24	B_u	292	273	23.58

Atom	x (Å)	y (Å)
C1	-0.045	0.766
C2	0.045	-0.766
S3	1.295	1.739
S4	-1.295	-1.739
N5	-1.295	1.221
N6	1.295	-1.221
H7	-2.061	0.563
H8	-1.461	2.211
H9	2.061	-0.563
H10	1.461	-2.211

	C1	C2	S3	S4	N5	N6	H7	H8	H9	H10
C1		1.5343	1.6562	2.8000	1.3310	2.3962	2.0263	2.0238	2.4894	3.3362
C2	1.5343		2.8000	1.6562	2.3962	1.3310	2.4894	3.3362	2.0263	2.0238
S3	1.6562	2.8000		4.3374	2.6422	2.9600	3.5564	2.7967	2.4258	3.9540
S4	2.8000	1.6562	4.3374		2.9600	2.6422	2.4258	3.9540	3.5564	2.7967
N5	1.3310	2.3962	2.6422	2.9600		3.5599	1.0092	1.0043	3.8005	4.4019
N6	2.3962	1.3310	2.9600	2.6422	3.5599		3.8005	4.4019	1.0092	1.0043
H7	2.0263	2.4894	3.5564	2.4258	1.0092	3.8005		1.7542	4.2722	4.4830
H8	2.0238	3.3362	2.7967	3.9540	1.0043	4.4019	1.7542		4.4830	5.3007
H9	2.4894	2.0263	2.4258	3.5564	3.8005	1.0092	4.2722	4.4830		1.7542
H10	3.3362	2.0238	3.9540	2.7967	4.4019	1.0043	4.4830	5.3007	1.7542

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S4	122.666	C1	C2	N6	113.313
C1	N5	H7	119.326	C1	N5	H8	119.481
C2	C1	S3	122.666	C2	C1	N5	113.313
C2	N6	H9	119.326	C2	N6	H10	119.481
S3	C1	N5	124.021	S4	C2	N6	124.021
H7	N5	H8	121.194	H9	N6	H10	121.194

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)

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

States and conformations

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)