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	hartrees
Energy at 0K	-255.829380
Energy at 298.15K	-255.834758
HF Energy	-255.250464
Nuclear repulsion energy	159.174034

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3592	3406	118.67
2	A'	3337	3164	1.41
3	A'	1413	1339	53.47
4	A'	1374	1302	7.13
5	A'	1196	1134	17.24
6	A'	1123	1065	6.43
7	A'	988	936	3.35
8	A'	978	927	1.50
9	A'	910	863	11.06
10	A'	811	769	2.69
11	A'	738	700	18.05
12	A"	886	840	24.22
13	A"	683	647	70.39
14	A"	669	634	3.45
15	A"	615	583	77.96

Atom	x (Å)	y (Å)
C1	1.088	0.265
N2	0.000	1.099
N3	-1.192	0.317
N4	-0.751	-1.004
N5	0.718	-1.028
H6	2.105	0.613
H7	-0.058	2.111

	C1	N2	N3	N4	N5	H6	H7
C1		1.3706	2.2805	2.2338	1.3443	1.0755	2.1730
N2	1.3706		1.4255	2.2327	2.2442	2.1607	1.0143
N3	2.2805	1.4255		1.3929	2.3359	3.3108	2.1228
N4	2.2338	2.2327	1.3929		1.4687	3.2821	3.1916
N5	1.3443	2.2442	2.3359	1.4687		2.1488	3.2334
H6	1.0755	2.1607	3.3108	3.2821	2.1488		2.6314
H7	2.1730	1.0143	2.1228	3.1916	3.2334	2.6314

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	109.276	C1	N2	H7	130.736
C1	N5	N4	105.054	N2	C1	N5	111.500
N2	C1	H6	123.634	N2	N3	N4	104.774
N3	N2	H7	119.987	N3	N4	N5	109.396
N5	C1	H6	124.866

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

using model chemistry: MP2=FULL/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 CH2N4 (1H-Tetrazole)

using model chemistry: MP2=FULL/3-21G*

States and conformations

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