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	hartrees
Energy at 0K	-319.493123
Energy at 298.15K	-319.498903
HF Energy	-318.550035
Nuclear repulsion energy	188.179187

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3223	3063	5.28
2	A'	3099	2945	15.17
3	A'	1877	1783	222.76
4	A'	1532	1455	6.05
5	A'	1491	1417	14.80
6	A'	1322	1257	211.85
7	A'	1213	1153	4.62
8	A'	1081	1027	112.32
9	A'	875	831	220.91
10	A'	688	653	29.64
11	A'	592	563	4.86
12	A'	357	339	2.24
13	A"	3196	3037	17.84
14	A"	1497	1423	8.28
15	A"	1198	1139	1.21
16	A"	767	729	12.31
17	A"	234	222	0.95
18	A"	138	131	2.61

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.619	0.000
O2	-1.210	0.553	0.000
O3	0.728	1.578	0.000
O4	0.716	-0.601	0.000
C5	-0.146	-1.743	0.000
H6	0.551	-2.580	0.000
H7	-0.773	-1.766	0.893
H8	-0.773	-1.766	-0.893

	N1	O2	O3	O4	C5	H6	H7	H8
N1		1.2116	1.2049	1.4142	2.3664	3.2454	2.6609	2.6609
O2	1.2116		2.1927	2.2449	2.5307	3.5938	2.5233	2.5233
O3	1.2049	2.1927		2.1797	3.4350	4.1619	3.7730	3.7730
O4	1.4142	2.2449	2.1797		1.4308	1.9853	2.0901	2.0901
C5	2.3664	2.5307	3.4350	1.4308		1.0891	1.0910	1.0910
H6	3.2454	3.5938	4.1619	1.9853	1.0891		1.7922	1.7922
H7	2.6609	2.5233	3.7730	2.0901	1.0910	1.7922		1.7863
H8	2.6609	2.5233	3.7730	2.0901	1.0910	1.7922	1.7863

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O4	C5	112.564	O2	N1	O3	130.287
O2	N1	O4	117.299	O3	N1	O4	112.414
O4	C5	H6	103.133	O4	C5	H7	111.243
O4	C5	H8	111.243	H6	C5	H7	110.589
H6	C5	H8	110.589	H7	C5	H8	109.891

All results from a given calculation for CH₃NO₃ (Methyl nitrate)

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 CH3NO3 (Methyl nitrate)

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

States and conformations

All results from a given calculation for CH₃NO₃ (Methyl nitrate)