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	hartrees
Energy at 0K	-257.178007
Energy at 298.15K	-257.183453
HF Energy	-256.614736
Nuclear repulsion energy	159.148322

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3672	3537	122.97
2	A'	3327	3205	1.79
3	A'	1445	1392	50.16
4	A'	1375	1324	9.39
5	A'	1173	1130	7.39
6	A'	1149	1106	13.62
7	A'	1004	967	3.64
8	A'	979	943	2.34
9	A'	959	924	15.54
10	A'	872	840	12.51
11	A'	812	782	9.20
12	A"	779	750	46.34
13	A"	756	728	139.73
14	A"	678	653	0.19
15	A"	639	615	9.05

Atom	x (Å)	y (Å)
C1	1.107	0.267
N2	0.000	1.094
N3	-1.187	0.325
N4	-0.749	-1.000
N5	0.693	-1.036
H6	2.136	0.604
H7	-0.072	2.108

	C1	N2	N3	N4	N5	H6	H7
C1		1.3820	2.2948	2.2475	1.3670	1.0823	2.1862
N2	1.3820		1.4141	2.2237	2.2395	2.1914	1.0161
N3	2.2948	1.4141		1.3952	2.3204	3.3343	2.1020
N4	2.2475	2.2237	1.3952		1.4424	3.3007	3.1800
N5	1.3670	2.2395	2.3204	1.4424		2.1840	3.2350
H6	1.0823	2.1914	3.3343	3.3007	2.1840		2.6718
H7	2.1862	1.0161	2.1020	3.1800	3.2350	2.6718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	110.307	C1	N2	H7	130.852
C1	N5	N4	106.225	N2	C1	N5	109.104
N2	C1	H6	125.115	N2	N3	N4	104.662
N3	N2	H7	118.841	N3	N4	N5	109.703
N5	C1	H6	125.781

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

using model chemistry: MP2/LANL2DZ

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/LANL2DZ

States and conformations

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