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	hartrees
Energy at 0K	-203.580241
Energy at 298.15K	-203.584814
HF Energy	-202.878855
Nuclear repulsion energy	107.116799

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3180	3063
2	A'	3035	2924
3	A'	2185	2104
4	A'	1486	1431
5	A'	1439	1386
6	A'	1313	1264
7	A'	1144	1102
8	A'	941	907
9	A'	655	631
10	A'	241	232
11	A"	3112	2997
12	A"	1486	1431
13	A"	1099	1058
14	A"	551	531
15	A"	105	101

Atom	x (Å)	y (Å)	z (Å)
C1	-0.079	-1.564	0.000
N2	0.708	-0.311	0.000
N3	0.000	0.718	0.000
N4	-0.527	1.745	0.000
H5	0.647	-2.391	0.000
H6	-0.716	-1.648	0.902
H7	-0.716	-1.648	-0.902

	C1	N2	N3	N4	H5	H6	H7
C1		1.4801	2.2838	3.3398	1.1001	1.1069	1.1069
N2	1.4801		1.2486	2.3984	2.0810	2.1514	2.1514
N3	2.2838	1.2486		1.1547	3.1755	2.6316	2.6316
N4	3.3398	2.3984	1.1547		4.2995	3.5164	3.5164
H5	1.1001	2.0810	3.1755	4.2995		1.7947	1.7947
H6	1.1069	2.1514	2.6316	3.5164	1.7947		1.8032
H7	1.1069	2.1514	2.6316	3.5164	1.7947	1.8032

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	113.365	N2	C1	H5	106.590
N2	C1	H6	111.719	N2	C1	H7	111.719
N2	N3	N4	172.661	H5	C1	H6	108.815
H5	C1	H7	108.815	H6	C1	H7	109.080

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

using model chemistry: CCSD(T)=FULL/cc-pVDZ

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: CCSD(T)=FULL/cc-pVDZ

States and conformations

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