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	hartrees
Energy at 0K	-312.730947
Energy at 298.15K	-312.738277
HF Energy	-311.780466
Nuclear repulsion energy	229.910881

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3662	3453	101.26
2	A	3661	3452	40.56
3	A	3556	3353	31.39
4	A	1711	1613	114.16
5	A	1642	1548	118.53
6	A	1528	1441	26.76
7	A	1385	1306	0.71
8	A	1205	1136	5.35
9	A	1177	1110	17.67
10	A	1140	1075	6.76
11	A	1115	1052	16.36
12	A	1075	1014	19.87
13	A	1015	957	0.44
14	A	829	782	240.38
15	A	733	692	3.72
16	A	719	678	10.39
17	A	688	649	78.45
18	A	554	522	78.42
19	A	386	364	15.19
20	A	299	282	1.86
21	A	216	203	60.50

Atom	x (Å)	y (Å)	z (Å)
C1	-0.623	-0.044	0.001
H2	-0.002	2.021	-0.078
N3	0.197	1.030	-0.005
N4	1.489	0.591	0.003
N5	1.419	-0.712	0.010
N6	0.121	-1.143	0.011
H7	-2.439	0.696	0.520
H8	-2.405	-0.908	0.038
N9	-2.000	0.013	-0.088

	C1	H2	N3	N4	N5	N6	H7	H8	N9
C1		2.1578	1.3516	2.2058	2.1488	1.3270	2.0282	1.9806	1.3804
H2	2.1578		1.0133	2.0672	3.0811	3.1669	2.8372	3.7905	2.8320
N3	1.3516	1.0133		1.3643	2.1275	2.1738	2.7083	3.2450	2.4221
N4	2.2058	2.0672	1.3643		1.3047	2.2082	3.9630	4.1729	3.5374
N5	2.1488	3.0811	2.1275	1.3047		1.3674	4.1382	3.8293	3.4962
N6	1.3270	3.1669	2.1738	2.2082	1.3674		3.1928	2.5373	2.4175
H7	2.0282	2.8372	2.7083	3.9630	4.1382	3.1928		1.6756	1.0138
H8	1.9806	3.7905	3.2450	4.1729	3.8293	2.5373	1.6756		1.0147
N9	1.3804	2.8320	2.4221	3.5374	3.4962	2.4175	1.0138	1.0147

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H2	131.150	C1	N3	N4	108.617
C1	N6	N5	105.768	C1	N9	H7	114.937
C1	N9	H8	110.640	H2	N3	N4	120.065
N3	C1	N6	108.488	N3	C1	N9	124.883
N3	N4	N5	105.689	N4	N5	N6	111.438
N6	C1	N9	126.475	H7	N9	H8	111.380

All results from a given calculation for CH₃N₅ (5-Aminotetrazole)

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 CH3N5 (5-Aminotetrazole)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for CH₃N₅ (5-Aminotetrazole)