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	hartrees
Energy at 0K	-982.814560
Energy at 298.15K	-982.820519
HF Energy	-981.984092
Nuclear repulsion energy	337.203919

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3708	3497	0.00
2	A_g	3530	3329	0.00
3	A_g	1675	1579	0.00
4	A_g	1476	1392	0.00
5	A_g	1356	1278	0.00
6	A_g	979	923	0.00
7	A_g	692	653	0.00
8	A_g	434	409	0.00
9	A_g	347	328	0.00
10	A_u	654	617	4.25
11	A_u	474	447	405.53
12	A_u	390	368	58.97
13	A_u	14	13	6.09
14	B_g	705	665	0.00
15	B_g	651	614	0.00
16	B_g	448	422	0.00
17	B_u	3710	3498	220.23
18	B_u	3537	3335	269.31
19	B_u	1635	1541	507.79
20	B_u	1471	1387	299.54
21	B_u	1257	1185	100.03
22	B_u	911	859	38.19
23	B_u	470	443	0.69
24	B_u	293	276	23.02

Atom	x (Å)	y (Å)
C1	-0.042	0.763
C2	0.042	-0.763
S3	1.298	1.739
S4	-1.298	-1.739
N5	-1.298	1.221
N6	1.298	-1.221
H7	-2.069	0.558
H8	-1.465	2.219
H9	2.069	-0.558
H10	1.465	-2.219

	C1	C2	S3	S4	N5	N6	H7	H8	H9	H10
C1		1.5284	1.6575	2.7999	1.3367	2.3939	2.0377	2.0362	2.4899	3.3415
C2	1.5284		2.7999	1.6575	2.3939	1.3367	2.4899	3.3415	2.0377	2.0362
S3	1.6575	2.7999		4.3402	2.6464	2.9606	3.5681	2.8039	2.4231	3.9624
S4	2.7999	1.6575	4.3402		2.9606	2.6464	2.4231	3.9624	3.5681	2.8039
N5	1.3367	2.3939	2.6464	2.9606		3.5636	1.0176	1.0123	3.8076	4.4123
N6	2.3939	1.3367	2.9606	2.6464	3.5636		3.8076	4.4123	1.0176	1.0123
H7	2.0377	2.4899	3.5681	2.4231	1.0176	3.8076		1.7683	4.2857	4.4945
H8	2.0362	3.3415	2.8039	3.9624	1.0123	4.4123	1.7683		4.4945	5.3186
H9	2.4899	2.0377	2.4231	3.5681	3.8076	1.0176	4.2857	4.4945		1.7683
H10	3.3415	2.0362	3.9624	2.8039	4.4123	1.0123	4.4945	5.3186	1.7683

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S4	122.957	C1	C2	N6	113.173
C1	N5	H7	119.262	C1	N5	H8	119.553
C2	C1	S3	122.957	C2	C1	N5	113.173
C2	N6	H9	119.262	C2	N6	H10	119.553
S3	C1	N5	123.869	S4	C2	N6	123.869
H7	N5	H8	121.185	H9	N6	H10	121.185

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

All results from a given calculation for C₂H₄N₂S₂ (Ethanedithioamide)