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	hartrees
Energy at 0K	-203.653965
Energy at 298.15K	-203.658467
HF Energy	-202.925941
Nuclear repulsion energy	107.778778

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3175	3058
2	A'	3037	2925
3	A'	2151	2072
4	A'	1509	1453
5	A'	1474	1420
6	A'	1295	1248
7	A'	1160	1117
8	A'	928	894
9	A'	641	617
10	A'	235	226
11	A"	3105	2991
12	A"	1496	1441
13	A"	1122	1080
14	A"	465	448
15	A"	109	105

Atom	x (Å)	y (Å)	z (Å)
C1	-0.088	-1.560	0.000
N2	0.701	-0.310	0.000
N3	0.000	0.715	0.000
N4	-0.509	1.740	0.000
H5	0.627	-2.379	0.000
H6	-0.717	-1.636	0.893
H7	-0.717	-1.636	-0.893

	C1	N2	N3	N4	H5	H6	H7
C1		1.4777	2.2763	3.3260	1.0881	1.0948	1.0948
N2	1.4777		1.2417	2.3804	2.0701	2.1364	2.1364
N3	2.2763	1.2417		1.1444	3.1570	2.6148	2.6148
N4	3.3260	2.3804	1.1444		4.2728	3.4977	3.4977
H5	1.0881	2.0701	3.1570	4.2728		1.7770	1.7770
H6	1.0948	2.1364	2.6148	3.4977	1.7770		1.7862
H7	1.0948	2.1364	2.6148	3.4977	1.7770	1.7862

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	113.377	N2	C1	H5	106.584
N2	C1	H6	111.430	N2	C1	H7	111.430
N2	N3	N4	172.088	H5	C1	H6	108.988
H5	C1	H7	108.988	H6	C1	H7	109.333

All results from a given calculation for CH₃N₃ (methyl azide)

using model chemistry: QCISD(T)/TZVP

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 CH3N3 (methyl azide)

using model chemistry: QCISD(T)/TZVP

States and conformations

All results from a given calculation for CH₃N₃ (methyl azide)