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	hartrees
Energy at 0K	-338.661250
Energy at 298.15K	-338.670230
HF Energy	-337.634467
Nuclear repulsion energy	257.687758

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3280	3091	0.00
2	A_g	3132	2951	0.00
3	A_g	1629	1535	0.00
4	A_g	1527	1438	0.00
5	A_g	1467	1382	0.00
6	A_g	1315	1239	0.00
7	A_g	1129	1064	0.00
8	A_g	736	694	0.00
9	A_g	619	584	0.00
10	A_g	405	382	0.00
11	A_u	3224	3037	4.56
12	A_u	1523	1435	22.44
13	A_u	1159	1092	0.04
14	A_u	307	290	3.81
15	A_u	189	178	7.90
16	A_u	133	125	6.78
17	B_g	3223	3037	0.00
18	B_g	1520	1432	0.00
19	B_g	1125	1060	0.00
20	B_g	426	402	0.00
21	B_g	176	166	0.00
22	B_u	3280	3091	0.54
23	B_u	3133	2952	5.88
24	B_u	1667	1571	130.17
25	B_u	1534	1445	31.15
26	B_u	1472	1387	8.59
27	B_u	1211	1141	0.67
28	B_u	996	938	5.97
29	B_u	555	523	46.50
30	B_u	298	281	29.38

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.679	0.000
N2	0.000	-0.679	0.000
O3	-1.078	1.339	0.000
O4	1.078	-1.339	0.000
C5	1.333	1.280	0.000
C6	-1.333	-1.280	0.000
H7	1.163	2.354	0.000
H8	1.878	0.951	0.886
H9	1.878	0.951	-0.886
H10	-1.163	-2.354	0.000
H11	-1.878	-0.951	0.886
H12	-1.878	-0.951	-0.886

	N1	N2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
N1		1.3571	1.2640	2.2874	1.4622	2.3692	2.0395	2.0943	2.0943	3.2477	2.6395	2.6395
N2	1.3571		2.2874	1.2640	2.3692	1.4622	3.2477	2.6395	2.6395	2.0395	2.0943	2.0943
O3	1.2640	2.2874		3.4378	2.4111	2.6317	2.4601	3.1100	3.1100	3.6937	2.5826	2.5826
O4	2.2874	1.2640	3.4378		2.6317	2.4111	3.6937	2.5826	2.5826	2.4601	3.1100	3.1100
C5	1.4622	2.3692	2.4111	2.6317		3.6960	1.0866	1.0914	1.0914	4.4086	4.0089	4.0089
C6	2.3692	1.4622	2.6317	2.4111	3.6960		4.4086	4.0089	4.0089	1.0866	1.0914	1.0914
H7	2.0395	3.2477	2.4601	3.6937	1.0866	4.4086		1.8065	1.8065	5.2509	4.5777	4.5777
H8	2.0943	2.6395	3.1100	2.5826	1.0914	4.0089	1.8065		1.7725	4.5777	4.2099	4.5678
H9	2.0943	2.6395	3.1100	2.5826	1.0914	4.0089	1.8065	1.7725		4.5777	4.5678	4.2099
H10	3.2477	2.0395	3.6937	2.4601	4.4086	1.0866	5.2509	4.5777	4.5777		1.8065	1.8065
H11	2.6395	2.0943	2.5826	3.1100	4.0089	1.0914	4.5777	4.2099	4.5678	1.8065		1.7725
H12	2.6395	2.0943	2.5826	3.1100	4.0089	1.0914	4.5777	4.5678	4.2099	1.8065	1.7725

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O4	121.503	N1	N2	C6	114.300
N1	C5	H7	105.340	N1	C5	H8	109.337
N1	C5	H9	109.337	N2	N1	O3	121.503
N2	N1	C5	114.300	N2	C6	H10	105.340
N2	C6	H11	109.337	N2	C6	H12	109.337
O3	N1	C5	124.197	O4	N2	C6	124.197
H7	C5	H8	112.080	H7	C5	H9	112.080
H8	C5	H9	108.585	H10	C6	H11	112.080
H10	C6	H12	112.080	H11	C6	H12	108.585

All results from a given calculation for C₂H₆N₂O₂ ((E)-Azodioxymethane)

using model chemistry: MP2=FULL/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 C2H6N2O2 ((E)-Azodioxymethane)

using model chemistry: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for C₂H₆N₂O₂ ((E)-Azodioxymethane)