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	hartrees
Energy at 0K	-258.102908
Energy at 298.15K	-258.098478
HF Energy	-256.754076
Nuclear repulsion energy	169.830849

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3925	3698	139.19
2	A'	3496	3294	0.29
3	A'	1722	1622	25.51
4	A'	1629	1535	11.45
5	A'	1549	1459	37.84
6	A'	1429	1347	1.11
7	A'	1262	1189	18.66
8	A'	1203	1134	35.67
9	A'	1182	1114	23.96
10	A'	1115	1050	1.66
11	A'	1093	1030	1.96
12	A"	1011	952	9.29
13	A"	815	768	8.77
14	A"	753	709	6.98
15	A"	623	587	131.33

Atom	x (Å)	y (Å)
C1	1.071	0.239
N2	0.000	1.055
N3	-1.127	0.317
N4	-0.721	-0.940
N5	0.639	-1.013
H6	2.099	0.568
H7	-0.061	2.067

	C1	N2	N3	N4	N5	H6	H7
C1		1.3466	2.1996	2.1458	1.3250	1.0792	2.1505
N2	1.3466		1.3468	2.1215	2.1644	2.1550	1.0141
N3	2.1996	1.3468		1.3212	2.2105	3.2358	2.0489
N4	2.1458	2.1215	1.3212		1.3618	3.1984	3.0790
N5	1.3250	2.1644	2.2105	1.3618		2.1526	3.1589
H6	1.0792	2.1550	3.2358	3.1984	2.1526		2.6297
H7	2.1505	1.0141	2.0489	3.0790	3.1589	2.6297

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	108.008	C1	N2	H7	131.229
C1	N5	N4	105.759	N2	C1	N5	108.177
N2	C1	H6	125.025	N2	N3	N4	106.684
N3	N2	H7	120.763	N3	N4	N5	111.372
N5	C1	H6	126.798

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

using model chemistry: G3

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: G3

States and conformations

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