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	hartrees
Energy at 0K	-338.826607
Energy at 298.15K	-338.835533
HF Energy	-337.724841
Nuclear repulsion energy	258.229120

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3250	3088	0.00
2	A_g	3102	2947	0.00
3	A_g	1620	1539	0.00
4	A_g	1493	1419	0.00
5	A_g	1440	1369	0.00
6	A_g	1295	1231	0.00
7	A_g	1117	1061	0.00
8	A_g	730	694	0.00
9	A_g	616	585	0.00
10	A_g	403	383	0.00
11	A_u	3190	3032	11.37
12	A_u	1485	1411	23.27
13	A_u	1139	1082	0.27
14	A_u	295	281	5.28
15	A_u	178	169	7.86
16	A_u	121	115	4.78
17	B_g	3190	3031	0.00
18	B_g	1484	1410	0.00
19	B_g	1109	1054	0.00
20	B_g	411	391	0.00
21	B_g	166	158	0.00
22	B_u	3250	3088	0.17
23	B_u	3102	2948	9.28
24	B_u	1670	1587	151.25
25	B_u	1497	1423	26.55
26	B_u	1443	1371	6.62
27	B_u	1199	1140	0.90
28	B_u	988	939	5.72
29	B_u	558	530	45.80
30	B_u	297	282	26.89

Atom	x (Å)	y (Å)	z (Å)
N1	-0.071	0.676	0.000
N2	0.071	-0.676	0.000
O3	-1.198	1.222	0.000
O4	1.198	-1.222	0.000
C5	1.198	1.409	0.000
C6	-1.198	-1.409	0.000
H7	0.922	2.460	0.000
H8	1.773	1.134	0.886
H9	1.773	1.134	-0.886
H10	-0.922	-2.460	0.000
H11	-1.773	-1.134	0.886
H12	-1.773	-1.134	-0.886

	N1	N2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12
N1		1.3586	1.2524	2.2821	1.4651	2.3700	2.0424	2.0960	2.0960	3.2498	2.6376	2.6376
N2	1.3586		2.2821	1.2524	2.3700	1.4651	3.2498	2.6376	2.6376	2.0424	2.0960	2.0960
O3	1.2524	2.2821		3.4216	2.4027	2.6308	2.4555	3.1012	3.1012	3.6924	2.5814	2.5814
O4	2.2821	1.2524	3.4216		2.6308	2.4027	3.6924	2.5814	2.5814	2.4555	3.1012	3.1012
C5	1.4651	2.3700	2.4027	2.6308		3.6988	1.0867	1.0917	1.0917	4.4124	4.0095	4.0095
C6	2.3700	1.4651	2.6308	2.4027	3.6988		4.4124	4.0095	4.0095	1.0867	1.0917	1.0917
H7	2.0424	3.2498	2.4555	3.6924	1.0867	4.4124		1.8080	1.8080	5.2554	4.5791	4.5791
H8	2.0960	2.6376	3.1012	2.5814	1.0917	4.0095	1.8080		1.7720	4.5791	4.2089	4.5667
H9	2.0960	2.6376	3.1012	2.5814	1.0917	4.0095	1.8080	1.7720		4.5791	4.5667	4.2089
H10	3.2498	2.0424	3.6924	2.4555	4.4124	1.0867	5.2554	4.5791	4.5791		1.8080	1.8080
H11	2.6376	2.0960	2.5814	3.1012	4.0095	1.0917	4.5791	4.2089	4.5667	1.8080		1.7720
H12	2.6376	2.0960	2.5814	3.1012	4.0095	1.0917	4.5791	4.5667	4.2089	1.8080	1.7720

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O4	121.806	N1	N2	C6	114.086
N1	C5	H7	105.374	N1	C5	H8	109.257
N1	C5	H9	109.257	N2	N1	O3	121.806
N2	N1	C5	114.086	N2	C6	H10	105.374
N2	C6	H11	109.257	N2	C6	H12	109.257
O3	N1	C5	124.108	O4	N2	C6	124.108
H7	C5	H8	112.184	H7	C5	H9	112.184
H8	C5	H9	108.498	H10	C6	H11	112.184
H10	C6	H12	112.184	H11	C6	H12	108.498

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

using model chemistry: MP2/6-311G**

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: MP2/6-311G**

States and conformations

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