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	hartrees
Energy at 0K	-312.732412
Energy at 298.15K	-312.739810
HF Energy	-311.786026
Nuclear repulsion energy	231.130083

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3724	3496	106.91
2	A	3680	3454	33.58
3	A	3586	3366	29.17
4	A	1737	1630	194.17
5	A	1680	1577	73.92
6	A	1573	1477	34.17
7	A	1455	1365	8.03
8	A	1362	1278	14.40
9	A	1191	1118	10.12
10	A	1158	1087	8.49
11	A	1127	1058	7.49
12	A	1103	1035	29.59
13	A	1039	975	2.87
14	A	832	781	224.31
15	A	747	701	2.70
16	A	731	687	4.88
17	A	701	658	95.74
18	A	523	491	101.70
19	A	393	369	14.54
20	A	310	291	3.45
21	A	233	218	59.97

Atom	x (Å)	y (Å)	z (Å)
C1	-0.619	-0.047	-0.002
H2	0.000	2.007	-0.090
N3	0.202	1.022	-0.009
N4	1.484	0.582	0.004
N5	1.416	-0.703	0.011
N6	0.118	-1.136	0.015
H7	-2.420	0.626	0.616
H8	-2.399	-0.903	-0.039
N9	-2.001	0.029	-0.088

	C1	H2	N3	N4	N5	N6	H7	H8	N9
C1		2.1472	1.3473	2.1942	2.1379	1.3149	2.0200	1.9764	1.3870
H2	2.1472		1.0091	2.0594	3.0597	3.1469	2.8749	3.7727	2.8145
N3	1.3473	1.0091		1.3553	2.1097	2.1593	2.7244	3.2363	2.4177
N4	2.1942	2.0594	1.3553		1.2869	2.1939	3.9517	4.1576	3.5294
N5	2.1379	3.0597	2.1097	1.2869		1.3676	4.1046	3.8209	3.4958
N6	1.3149	3.1469	2.1593	2.1939	1.3676		3.1477	2.5292	2.4203
H7	2.0200	2.8749	2.7244	3.9517	4.1046	3.1477		1.6639	1.0143
H8	1.9764	3.7727	3.2363	4.1576	3.8209	2.5292	1.6639		1.0146
N9	1.3870	2.8145	2.4177	3.5294	3.4958	2.4203	1.0143	1.0146

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H2	130.808	C1	N3	N4	108.557
C1	N6	N5	105.667	C1	N9	H7	113.628
C1	N9	H8	109.788	H2	N3	N4	120.445
N3	C1	N6	108.394	N3	C1	N9	124.296
N3	N4	N5	105.937	N4	N5	N6	111.442
N6	C1	N9	127.188	H7	N9	H8	110.183

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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