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	hartrees
Energy at 0K	-339.615334
Energy at 298.15K	-339.624443
Nuclear repulsion energy	261.356288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3185	3066	6.14
2	A	3181	3063	2.15
3	A	3135	3018	37.28
4	A	3130	3013	0.22
5	A	3034	2921	52.51
6	A	3028	2915	24.13
7	A	1667	1604	314.46
8	A	1532	1474	52.96
9	A	1510	1454	19.72
10	A	1510	1453	0.20
11	A	1490	1434	11.28
12	A	1487	1431	46.27
13	A	1444	1390	11.91
14	A	1362	1312	289.16
15	A	1338	1288	0.89
16	A	1285	1237	5.51
17	A	1160	1117	44.75
18	A	1132	1089	1.76
19	A	1064	1024	11.37
20	A	1021	983	75.51
21	A	878	845	11.19
22	A	794	764	18.21
23	A	636	612	1.16
24	A	625	601	9.67
25	A	423	407	3.47
26	A	361	347	2.11
27	A	207	199	9.04
28	A	141	136	0.45
29	A	135	130	3.33
30	A	120	115	0.07

Atom	x (Å)	y (Å)	z (Å)
O1	1.353	1.087	0.031
O2	1.353	-1.087	0.031
H3	-1.228	1.515	1.115
H4	-2.267	1.156	-0.290
H5	-0.755	2.057	-0.509
C6	-1.236	1.257	0.049
H7	-1.229	-1.514	1.115
H8	-0.754	-2.057	-0.507
H9	-2.267	-1.157	-0.291
C10	-1.236	-1.257	0.049
N11	0.803	-0.000	-0.028
N12	-0.563	-0.000	-0.217

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.1737	2.8317	3.6353	2.3830	2.5949	3.8220	3.8230	4.2711	3.4925	1.2198	2.2169
O2	2.1737		3.8215	4.2711	3.8236	3.4924	2.8334	2.3819	3.6352	2.5951	1.2197	2.2170
H3	2.8317	3.8215		1.7837	1.7756	1.0969	3.0282	3.9511	3.1926	2.9692	2.7789	2.1237
H4	3.6353	4.2711	1.7837		1.7734	1.0899	3.1903	3.5581	2.3128	2.6456	3.2909	2.0607
H5	2.3830	3.8236	1.7756	1.7734		1.0871	3.9508	4.1136	3.5578	3.3941	2.6247	2.0862
C6	2.5949	3.4924	1.0969	1.0899	1.0871		2.9685	3.3943	2.6462	2.5133	2.3962	1.4502
H7	3.8220	2.8334	3.0282	3.1903	3.9508	2.9685		1.7756	1.7837	1.0969	2.7798	2.1237
H8	3.8230	2.3819	3.9511	3.5581	4.1136	3.3943	1.7756		1.7733	1.0871	2.6240	2.0861
H9	4.2711	3.6352	3.1926	2.3128	3.5578	2.6462	1.7837	1.7733		1.0899	3.2909	2.0608
C10	3.4925	2.5951	2.9692	2.6456	3.3941	2.5133	1.0969	1.0871	1.0899		2.3963	1.4502
N11	1.2198	1.2197	2.7789	3.2909	2.6247	2.3962	2.7798	2.6240	3.2909	2.3963		1.3788
N12	2.2169	2.2170	2.1237	2.0607	2.0862	1.4502	2.1237	2.0861	2.0608	1.4502	1.3788

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	126.006	O1	N11	N12	116.981
O2	N11	N12	116.985	H3	C6	H4	109.301
H3	C6	H5	108.781	H3	C6	N12	112.236
H4	C6	H5	109.093	H4	C6	N12	107.595
H5	C6	N12	109.786	C6	N12	C10	120.120
C6	N12	N11	115.757	H7	C10	H8	108.783
H7	C10	H9	109.302	H7	C10	N12	112.237
H8	C10	H9	109.093	H8	C10	N12	109.780
H9	C10	N12	107.599	C10	N12	N11	115.763

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: B3PW91/6-311G*

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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Number	Element	Mulliken
1	O	-0.313
2	O	-0.314
3	H	0.238
4	H	0.233
5	H	0.270
6	C	-0.521
7	H	0.237
8	H	0.270
9	H	0.233
10	C	-0.521
11	N	0.417
12	N	-0.230

	x	y	z	Total
	-4.532	-0.000	0.149	4.534
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	148.349
(<r²>)^1/2	12.180

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: B3PW91/6-311G*

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)