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	hartrees
Energy at 0K	-492.030574
Energy at 298.15K	-492.034213
HF Energy	-491.575648
Nuclear repulsion energy	94.490642

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3820	3562	51.40
2	A'	3675	3428	95.98
3	A'	3195	2980	22.85
4	A'	1698	1584	202.42
5	A'	1519	1417	193.05
6	A'	1348	1257	184.26
7	A'	1178	1099	22.79
8	A'	909	848	14.70
9	A'	443	413	1.73
10	A"	987	920	25.43
11	A"	624	582	7.49
12	A"	284	265	243.50

Atom	x (Å)	y (Å)
C1	0.000	0.638
S2	-0.778	-0.808
N3	1.332	0.823
H4	-0.550	1.576
H5	1.942	0.022
H6	1.736	1.742

	C1	S2	N3	H4	H5	H6
C1		1.6419	1.3452	1.0879	2.0376	2.0575
S2	1.6419		2.6673	2.3951	2.8448	3.5812
N3	1.3452	2.6673		2.0280	1.0062	1.0041
H4	1.0879	2.3951	2.0280		2.9374	2.2924
H5	2.0376	2.8448	1.0062	2.9374		1.7319
H6	2.0575	3.5812	1.0041	2.2924	1.7319

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.422	C1	N3	H6	121.601
S2	C1	N3	126.198	S2	C1	H4	121.313
H5	N3	H6	118.977

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CCSD/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 CHSNH2 (thioformamide)

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

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)