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	hartrees
Energy at 0K	-338.639237
Energy at 298.15K	-338.648189
HF Energy	-337.633922
Nuclear repulsion energy	257.422122

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3279	3092	0.00
2	A_g	3132	2953	0.00
3	A_g	1626	1534	0.00
4	A_g	1526	1439	0.00
5	A_g	1465	1382	0.00
6	A_g	1312	1237	0.00
7	A_g	1127	1063	0.00
8	A_g	733	691	0.00
9	A_g	617	582	0.00
10	A_g	404	381	0.00
11	A_u	3223	3039	4.71
12	A_u	1522	1435	22.10
13	A_u	1157	1091	0.05
14	A_u	305	288	3.75
15	A_u	188	177	8.15
16	A_u	131	123	6.57
17	B_g	3223	3039	0.00
18	B_g	1519	1433	0.00
19	B_g	1122	1058	0.00
20	B_g	418	394	0.00
21	B_g	173	163	0.00
22	B_u	3280	3093	0.51
23	B_u	3132	2954	5.98
24	B_u	1667	1572	128.81
25	B_u	1534	1446	30.53
26	B_u	1470	1386	8.15
27	B_u	1209	1140	0.68
28	B_u	993	936	5.91
29	B_u	554	522	46.66
30	B_u	297	280	29.36

Atom	x (Å)	y (Å)	z (Å)
N1	-0.062	0.665	0.000
N2	0.062	-0.665	0.000
O3	-1.194	1.251	0.000
O4	1.194	-1.251	0.000
C5	1.194	1.406	0.000
C6	-1.194	-1.406	0.000
H7	0.902	2.455	0.000
H8	1.775	1.151	0.890
H9	1.775	1.151	-0.890
H10	-0.902	-2.455	0.000
H11	-1.775	-1.151	0.890
H12	-1.775	-1.151	-0.890

	N1	N2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
N1		1.3354	1.2748	2.2911	1.4584	2.3602	2.0329	2.0986	2.0986	3.2305	2.6506	2.6506
N2	1.3354		2.2911	1.2748	2.3602	1.4584	3.2305	2.6506	2.6506	2.0329	2.0986	2.0986
O3	1.2748	2.2911		3.4590	2.3928	2.6576	2.4168	3.1011	3.1011	3.7174	2.6275	2.6275
O4	2.2911	1.2748	3.4590		2.6576	2.3928	3.7174	2.6275	2.6275	2.4168	3.1011	3.1011
C5	1.4584	2.3602	2.3928	2.6576		3.6893	1.0882	1.0934	1.0934	4.3930	4.0185	4.0185
C6	2.3602	1.4584	2.6576	2.3928	3.6893		4.3930	4.0185	4.0185	1.0882	1.0934	1.0934
H7	2.0329	3.2305	2.4168	3.7174	1.0882	4.3930		1.8036	1.8036	5.2302	4.5785	4.5785
H8	2.0986	2.6506	3.1011	2.6275	1.0934	4.0185	1.8036		1.7808	4.5785	4.2314	4.5909
H9	2.0986	2.6506	3.1011	2.6275	1.0934	4.0185	1.8036	1.7808		4.5785	4.5909	4.2314
H10	3.2305	2.0329	3.7174	2.4168	4.3930	1.0882	5.2302	4.5785	4.5785		1.8036	1.8036
H11	2.6506	2.0986	2.6275	3.1011	4.0185	1.0934	4.5785	4.2314	4.5909	1.8036		1.7808
H12	2.6506	2.0986	2.6275	3.1011	4.0185	1.0934	4.5785	4.5909	4.2314	1.8036	1.7808

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O4	122.723	N1	N2	C6	115.225
N1	C5	H7	105.003	N1	C5	H8	109.828
N1	C5	H9	109.828	N2	N1	O3	122.723
N2	N1	C5	115.225	N2	C6	H10	105.003
N2	C6	H11	109.828	N2	C6	H12	109.828
O3	N1	C5	122.052	O4	N2	C6	122.052
H7	C5	H8	111.534	H7	C5	H9	111.534
H8	C5	H9	109.049	H10	C6	H11	111.534
H10	C6	H12	111.534	H11	C6	H12	109.049

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

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 C2H6N2O2 ((E)-Azodioxymethane)

using model chemistry: MP2/6-31G*

States and conformations

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