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	hartrees
Energy at 0K	-489.513096
Energy at 298.15K	-489.517060
HF Energy	-489.203553
Nuclear repulsion energy	94.322306

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3712	3468	48.16
2	A'	3584	3349	98.19
3	A'	3165	2957	20.14
4	A'	1752	1637	137.67
5	A'	1539	1438	165.25
6	A'	1346	1258	283.26
7	A'	1223	1143	27.17
8	A'	912	853	22.49
9	A'	458	428	2.13
10	A"	1030	963	21.48
11	A"	717	670	170.92
12	A"	555	518	181.75

Atom	x (Å)	y (Å)
C1	0.000	0.638
S2	-0.780	-0.809
N3	1.335	0.824
H4	-0.561	1.572
H5	1.948	0.020
H6	1.744	1.747

	C1	S2	N3	H4	H5	H6
C1		1.6437	1.3475	1.0892	2.0440	2.0666
S2	1.6437		2.6715	2.3909	2.8512	3.5917
N3	1.3475	2.6715		2.0374	1.0115	1.0094
H4	1.0892	2.3909	2.0374		2.9501	2.3113
H5	2.0440	2.8512	1.0115	2.9501		1.7386
H6	2.0666	3.5917	1.0094	2.3113	1.7386

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.422	C1	N3	H6	121.871
S2	C1	N3	126.255	S2	C1	H4	120.704
H5	N3	H6	118.707

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CISD/3-21G*

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 CHSNH2 (thioformamide)

using model chemistry: CISD/3-21G*

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)