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	hartrees
Energy at 0K	-982.941443
Energy at 298.15K
HF Energy	-982.070235
Nuclear repulsion energy	337.409947

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3738	3552	0.00
2	A_g	3564	3387	0.00
3	A_g	1686	1602	0.00
4	A_g	1472	1399	0.00
5	A_g	1348	1281	0.00
6	A_g	973	925	0.00
7	A_g	687	653	0.00
8	A_g	424	403	0.00
9	A_g	340	323	0.00
10	A_u	637	605	0.62
11	A_u	379	361	11.84
12	A_u	331	315	469.21
13	A_u	57i	54i	0.32
14	B_g	657	624	0.00
15	B_g	633	601	0.00
16	B_g	281	267	0.00
17	B_u	3739	3553	183.66
18	B_u	3569	3391	258.32
19	B_u	1654	1572	447.60
20	B_u	1458	1386	386.54
21	B_u	1254	1192	117.62
22	B_u	910	865	39.24
23	B_u	466	443	1.14
24	B_u	283	269	21.69

Atom	x (Å)	y (Å)
C1	-0.042	0.765
C2	0.042	-0.765
S3	1.297	1.738
S4	-1.297	-1.738
N5	-1.297	1.222
N6	1.297	-1.222
H7	-2.067	0.566
H8	-1.465	2.215
H9	2.067	-0.566
H10	1.465	-2.215

	C1	C2	S3	S4	N5	N6	H7	H8	H9	H10
C1		1.5330	1.6550	2.8005	1.3356	2.3964	2.0346	2.0310	2.4938	3.3392
C2	1.5330		2.8005	1.6550	2.3964	1.3356	2.4938	3.3392	2.0346	2.0310
S3	1.6550	2.8005		4.3375	2.6447	2.9604	3.5620	2.8024	2.4295	3.9565
S4	2.8005	1.6550	4.3375		2.9604	2.6447	2.4295	3.9565	3.5620	2.8024
N5	1.3356	2.3964	2.6447	2.9604		3.5641	1.0114	1.0066	3.8095	4.4089
N6	2.3964	1.3356	2.9604	2.6447	3.5641		3.8095	4.4089	1.0114	1.0066
H7	2.0346	2.4938	3.5620	2.4295	1.0114	3.8095		1.7551	4.2857	4.4948
H8	2.0310	3.3392	2.8024	3.9565	1.0066	4.4089	1.7551		4.4948	5.3104
H9	2.4938	2.0346	2.4295	3.5620	3.8095	1.0114	4.2857	4.4948		1.7551
H10	3.3392	2.0310	3.9565	2.8024	4.4089	1.0066	4.4948	5.3104	1.7551

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S4	122.872	C1	C2	N6	113.134
C1	N5	H7	119.558	C1	N5	H8	119.592
C2	C1	S3	122.872	C2	C1	N5	113.134
C2	N6	H9	119.558	C2	N6	H10	119.592
S3	C1	N5	123.995	S4	C2	N6	123.995
H7	N5	H8	120.850	H9	N6	H10	120.850

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)

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 C2H4N2S2 (Ethanedithioamide)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)