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	hartrees
Energy at 0K	-983.198657
Energy at 298.15K
HF Energy	-982.092623
Nuclear repulsion energy	336.229088

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3702	3539
2	A_g	3512	3357
3	A_g	1633	1561
4	A_g	1429	1366
5	A_g	1334	1275
6	A_g	948	907
7	A_g	674	645
8	A_g	410	392
9	A_g	332	317
10	A_u	618	590
11	A_u	338	323
12	A_u	200	192
13	A_u	146i	140i
14	B_g	618	590
15	B_g	585	559
16	B_g	135	129
17	B_u	3704	3541
18	B_u	3519	3364
19	B_u	1602	1531
20	B_u	1417	1354
21	B_u	1232	1178
22	B_u	866	828
23	B_u	457	437
24	B_u	275	263

Atom	x (Å)	y (Å)
C1	-0.047	0.765
C2	0.047	-0.765
S3	1.303	1.749
S4	-1.303	-1.749
N5	-1.303	1.216
N6	1.303	-1.216
H7	-2.062	0.543
H8	-1.477	2.208
H9	2.062	-0.543
H10	1.477	-2.208

	C1	C2	S3	S4	N5	N6	H7	H8	H9	H10
C1		1.5327	1.6708	2.8100	1.3345	2.3971	2.0272	2.0312	2.4818	3.3405
C2	1.5327		2.8100	1.6708	2.3971	1.3345	2.4818	3.3405	2.0272	2.0312
S3	1.6708	2.8100		4.3619	2.6605	2.9644	3.5749	2.8177	2.4141	3.9603
S4	2.8100	1.6708	4.3619		2.9644	2.6605	2.4141	3.9603	3.5749	2.8177
N5	1.3345	2.3971	2.6605	2.9644		3.5644	1.0141	1.0072	3.7972	4.4100
N6	2.3971	1.3345	2.9644	2.6605	3.5644		3.7972	4.4100	1.0141	1.0072
H7	2.0272	2.4818	3.5749	2.4141	1.0141	3.7972		1.7647	4.2648	4.4822
H8	2.0312	3.3405	2.8177	3.9603	1.0072	4.4100	1.7647		4.4822	5.3123
H9	2.4818	2.0272	2.4141	3.5749	3.7972	1.0141	4.2648	4.4822		1.7647
H10	3.3405	2.0312	3.9603	2.8177	4.4100	1.0072	4.4822	5.3123	1.7647

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S4	122.549	C1	C2	N6	113.267
C1	N5	H7	118.706	C1	N5	H8	119.660
C2	C1	S3	122.549	C2	C1	N5	113.267
C2	N6	H9	118.706	C2	N6	H10	119.660
S3	C1	N5	124.183	S4	C2	N6	124.183
H7	N5	H8	121.634	H9	N6	H10	121.634

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)

using model chemistry: CCSD(T)=FULL/TZVP

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: CCSD(T)=FULL/TZVP

States and conformations

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)