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	hartrees
Energy at 0K	-337.942962
Energy at 298.15K	-337.951832
Nuclear repulsion energy	260.488828

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3152	3104	0.00
2	A_g	2996	2951	0.00
3	A_g	1576	1553	0.00
4	A_g	1413	1392	0.00
5	A_g	1393	1372	0.00
6	A_g	1341	1320	0.00
7	A_g	1059	1043	0.00
8	A_g	800	788	0.00
9	A_g	629	620	0.00
10	A_g	400	394	0.00
11	A_u	3073	3027	1.12
12	A_u	1386	1365	38.25
13	A_u	1076	1060	1.17
14	A_u	310	305	5.44
15	A_u	189	187	12.81
16	A_u	95	94	2.72
17	B_g	3073	3027	0.00
18	B_g	1382	1362	0.00
19	B_g	1053	1037	0.00
20	B_g	502	494	0.00
21	B_g	135	133	0.00
22	B_u	3152	3105	2.75
23	B_u	2997	2952	5.57
24	B_u	1452	1430	186.23
25	B_u	1390	1370	169.35
26	B_u	1343	1323	59.23
27	B_u	1148	1130	2.66
28	B_u	952	937	33.40
29	B_u	544	536	29.24
30	B_u	290	286	25.43

Atom	x (Å)	y (Å)	z (Å)
N1	-0.059	0.654	0.000
N2	0.059	-0.654	0.000
O3	-1.190	1.209	0.000
O4	1.190	-1.209	0.000
C5	1.190	1.380	0.000
C6	-1.190	-1.380	0.000
H7	0.921	2.443	0.000
H8	1.781	1.100	0.888
H9	1.781	1.100	-0.888
H10	-0.921	-2.443	0.000
H11	-1.781	-1.100	0.888
H12	-1.781	-1.100	-0.888

	N1	N2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
N1		1.3140	1.2598	2.2437	1.4453	2.3280	2.0399	2.0918	2.0918	3.2151	2.6138	2.6138
N2	1.3140		2.2437	1.2598	2.3280	1.4453	3.2151	2.6138	2.6138	2.0399	2.0918	2.0918
O3	1.2598	2.2437		3.3935	2.3869	2.5896	2.4456	3.1036	3.1036	3.6622	2.5436	2.5436
O4	2.2437	1.2598	3.3935		2.5896	2.3869	3.6622	2.5436	2.5436	2.4456	3.1036	3.1036
C5	1.4453	2.3280	2.3869	2.5896		3.6456	1.0963	1.1032	1.1032	4.3678	3.9715	3.9715
C6	2.3280	1.4453	2.5896	2.3869	3.6456		4.3678	3.9715	3.9715	1.0963	1.1032	1.1032
H7	2.0399	3.2151	2.4456	3.6622	1.0963	4.3678		1.8258	1.8258	5.2220	4.5438	4.5438
H8	2.0918	2.6138	3.1036	2.5436	1.1032	3.9715	1.8258		1.7764	4.5438	4.1873	4.5485
H9	2.0918	2.6138	3.1036	2.5436	1.1032	3.9715	1.8258	1.7764		4.5438	4.5485	4.1873
H10	3.2151	2.0399	3.6622	2.4456	4.3678	1.0963	5.2220	4.5438	4.5438		1.8258	1.8258
H11	2.6138	2.0918	2.5436	3.1036	3.9715	1.1032	4.5438	4.1873	4.5485	1.8258		1.7764
H12	2.6138	2.0918	2.5436	3.1036	3.9715	1.1032	4.5438	4.5485	4.1873	1.8258	1.7764

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O4	121.306	N1	N2	C6	114.983
N1	C5	H7	105.942	N1	C5	H8	109.604
N1	C5	H9	109.604	N2	N1	O3	121.306
N2	N1	C5	114.983	N2	C6	H10	105.942
N2	C6	H11	109.604	N2	C6	H12	109.604
O3	N1	C5	123.712	O4	N2	C6	123.712
H7	C5	H8	112.218	H7	C5	H9	112.218
H8	C5	H9	107.244	H10	C6	H11	112.218
H10	C6	H12	112.218	H11	C6	H12	107.244

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

using model chemistry: LSDA/6-31+G**

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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Number	Element	Mulliken
1	N	0.014
2	N	0.014
3	O	-0.228
4	O	-0.228
5	C	-0.462
6	C	-0.462
7	H	0.221
8	H	0.228
9	H	0.228
10	H	0.221
11	H	0.228
12	H	0.228

	x	y	z
x	9.068	-0.710	0.000
y	-0.710	10.252	0.000
z	0.000	0.000	5.596

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/6-31+G**

States and conformations

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