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	hartrees
Energy at 0K	-257.615546
Energy at 298.15K	-257.621145
HF Energy	-256.786802
Nuclear repulsion energy	165.002234

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3652	3502	109.22
2	A'	3327	3191	3.29
3	A'	1478	1417	14.40
4	A'	1462	1402	16.67
5	A'	1247	1196	1.15
6	A'	1171	1123	1.16
7	A'	1127	1081	10.29
8	A'	1102	1057	12.00
9	A'	1069	1025	31.92
10	A'	995	955	2.47
11	A'	948	909	2.48
12	A"	810	776	26.18
13	A"	725	695	13.91
14	A"	690	662	13.24
15	A"	611	586	59.86

Atom	x (Å)	y (Å)
C1	1.075	0.235
N2	0.000	1.064
N3	-1.121	0.309
N4	-0.730	-0.932
N5	0.637	-1.019
H6	2.111	0.563
H7	-0.061	2.076

	C1	N2	N3	N4	N5	H6	H7
C1		1.3577	2.1979	2.1498	1.3285	1.0860	2.1635
N2	1.3577		1.3519	2.1254	2.1783	2.1694	1.0138
N3	2.1979	1.3519		1.3012	2.2035	3.2420	2.0606
N4	2.1498	2.1254	1.3012		1.3699	3.2100	3.0815
N5	1.3285	2.1783	2.2035	1.3699		2.1618	3.1728
H6	1.0860	2.1694	3.2420	3.2100	2.1618		2.6472
H7	2.1635	1.0138	2.0606	3.0815	3.1728	2.6472

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	108.419	C1	N2	H7	131.095
C1	N5	N4	105.620	N2	C1	N5	108.368
N2	C1	H6	124.817	N2	N3	N4	106.453
N3	N2	H7	120.486	N3	N4	N5	111.142
N5	C1	H6	126.815

All results from a given calculation for CH₂N₄ (1H-Tetrazole)

using model chemistry: MP2/aug-cc-pVDZ

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 CH2N4 (1H-Tetrazole)

using model chemistry: MP2/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂N₄ (1H-Tetrazole)