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	hartrees
Energy at 0K	-296.712863
Energy at 298.15K	-296.720397
HF Energy	-295.785972
Nuclear repulsion energy	230.469695

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3344	3153	0.01
2	A	3265	3079	0.14
3	A	3244	3059	2.85
4	A	3142	2963	11.03
5	A	1562	1473	8.59
6	A	1535	1448	11.18
7	A	1491	1406	0.17
8	A	1483	1399	5.14
9	A	1453	1370	9.14
10	A	1358	1281	12.65
11	A	1317	1242	15.52
12	A	1253	1182	0.10
13	A	1180	1113	18.59
14	A	1178	1110	0.01
15	A	1081	1020	8.75
16	A	1048	988	15.90
17	A	1007	950	2.28
18	A	869	819	13.61
19	A	718	677	15.58
20	A	711	671	4.77
21	A	684	645	6.22
22	A	371	350	5.33
23	A	236	222	5.66
24	A	70	66	0.00

Atom	x (Å)	y (Å)	z (Å)
H1	2.306	-1.210	0.001
C2	1.412	-0.605	0.001
N3	0.177	-1.127	-0.000
N4	1.423	0.749	-0.001
N5	0.149	1.124	0.001
N6	-0.559	-0.016	-0.000
H7	-2.362	-0.549	-0.892
H8	-2.334	1.008	-0.002
H9	-2.362	-0.544	0.895
C10	-2.009	-0.031	-0.000

	H1	C2	N3	N4	N5	N6	H7	H8	H9	C10
H1		1.0798	2.1309	2.1497	3.1778	3.1036	4.7984	5.1426	4.7992	4.4730
C2	1.0798		1.3412	1.3540	2.1404	2.0567	3.8787	4.0780	3.8789	3.4686
N3	2.1309	1.3412		2.2522	2.2507	1.3322	2.7523	3.2953	2.7541	2.4448
N4	2.1497	1.3540	2.2522		1.3270	2.1239	4.0989	3.7650	4.0985	3.5190
N5	3.1778	2.1404	2.2507	1.3270		1.3418	3.1465	2.4857	3.1445	2.4478
N6	3.1036	2.0567	1.3322	2.1239	1.3418		2.0812	2.0492	2.0813	1.4503
H7	4.7984	3.8787	2.7523	4.0989	3.1465	2.0812		1.7931	1.7871	1.0902
H8	5.1426	4.0780	3.2953	3.7650	2.4857	2.0492	1.7931		1.7930	1.0887
H9	4.7992	3.8789	2.7541	4.0985	3.1445	2.0813	1.7871	1.7930		1.0902
C10	4.4730	3.4686	2.4448	3.5190	2.4478	1.4503	1.0902	1.0887	1.0902

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	N3	122.957	H1	C2	N4	123.683
C2	N3	N6	100.585	C2	N4	N5	105.942
N3	C2	N4	113.360	N3	N6	N5	114.645
N3	N6	C10	122.905	N4	N5	N6	105.468
N5	N6	C10	122.449	N6	C10	H7	109.194
N6	C10	H8	106.757	N6	C10	H9	109.200
H7	C10	H8	110.761	H7	C10	H9	110.096
H8	C10	H9	110.754

All results from a given calculation for C₂H₄N₄ (2H-Tetrazole, 2-methyl-)

using model chemistry: MP2/6-31G*

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 C2H4N4 (2H-Tetrazole, 2-methyl-)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for C₂H₄N₄ (2H-Tetrazole, 2-methyl-)