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	hartrees
Energy at 0K	-48.059769
Energy at 298.15K	-48.067550
HF Energy	-47.349039
Nuclear repulsion energy	97.074283

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3760	3570	87.83
2	A	3613	3431	8.34
3	A	3598	3416	86.19
4	A	3589	3408	49.60
5	A	3495	3318	1.59
6	A	1715	1629	41.56
7	A	1636	1553	246.59
8	A	1530	1453	197.23
9	A	1465	1391	53.53
10	A	1324	1257	1.66
11	A	1316	1250	262.65
12	A	1188	1128	48.99
13	A	1041	989	62.36
14	A	982	932	92.37
15	A	847	804	29.88
16	A	663	630	29.05
17	A	613	582	10.65
18	A	564	535	81.84
19	A	509	483	4.49
20	A	414	393	158.15
21	A	383	363	126.26
22	A	292	277	53.27
23	A	236	224	80.59
24	A	130	123	49.51

Atom	x (Å)	y (Å)	z (Å)
H1	-0.612	-1.682	0.092
N2	-0.865	-0.726	-0.171
S3	1.770	-0.352	0.032
C4	0.183	0.183	-0.037
H5	-1.186	1.722	-0.139
H6	0.522	2.197	-0.078
N7	-0.204	1.493	0.016
H8	-2.495	-0.543	1.015
H9	-2.811	-0.711	-0.610
N10	-2.194	-0.261	0.073

	H1	N2	S3	C4	H5	H6	N7	H8	H9	N10
H1		1.0232	2.7289	2.0312	3.4592	4.0440	3.2014	2.3870	2.5042	2.1263
N2	1.0232		2.6700	1.3941	2.4686	3.2363	2.3226	2.0238	1.9944	1.4282
S3	2.7289	2.6700		1.6762	3.6147	2.8395	2.7021	4.3816	4.6399	3.9652
C4	2.0312	1.3941	1.6762		2.0620	2.0422	1.3669	2.9680	3.1767	2.4205
H5	3.4592	2.4686	3.6147	2.0620		1.7735	1.0196	2.8593	2.9632	2.2344
H6	4.0440	3.2363	2.8395	2.0422	1.7735		1.0157	4.2193	4.4547	3.6657
N7	3.2014	2.3226	2.7021	1.3669	1.0196	1.0157		3.2234	3.4702	2.6526
H8	2.3870	2.0238	4.3816	2.9680	2.8593	4.2193	3.2234		1.6637	1.0281
H9	2.5042	1.9944	4.6399	3.1767	2.9632	4.4547	3.4702	1.6637		1.0248
N10	2.1263	1.4282	3.9652	2.4205	2.2344	3.6657	2.6526	1.0281	1.0248

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	N2	C4	113.451	H1	N2	N10	119.400
N2	C4	S3	120.550	N2	C4	N7	114.530
N2	N10	H8	109.890	N2	N10	H9	107.656
S3	C4	N7	124.918	C4	N2	N10	118.101
C4	N7	H5	118.818	C4	N7	H6	117.223
H5	N7	H6	121.240	H8	N10	H9	108.274

All results from a given calculation for CH₅N₃S (Hydrazinecarbothioamide)

using model chemistry: MP2/CEP-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 CH5N3S (Hydrazinecarbothioamide)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for CH₅N₃S (Hydrazinecarbothioamide)