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	hartrees
Energy at 0K	-319.310912
Energy at 298.15K	-319.316737
HF Energy	-318.468118
Nuclear repulsion energy	188.956123

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3252	3052	4.44
2	A'	3139	2946	11.17
3	A'	1859	1745	422.34
4	A'	1557	1461	5.30
5	A'	1525	1432	42.46
6	A'	1426	1338	204.74
7	A'	1238	1162	3.35
8	A'	1111	1043	138.51
9	A'	950	891	115.58
10	A'	714	670	2.75
11	A'	615	577	4.78
12	A'	366	344	4.34
13	A"	3235	3037	11.82
14	A"	1537	1443	8.20
15	A"	1207	1133	1.22
16	A"	792	744	20.51
17	A"	231	217	0.88
18	A"	139	131	2.53

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.608	0.000
O2	-1.210	0.540	0.000
O3	0.705	1.583	0.000
O4	0.712	-0.578	0.000
C5	-0.127	-1.748	0.000
H6	0.596	-2.563	0.000
H7	-0.749	-1.779	0.895
H8	-0.749	-1.779	-0.895

	N1	O2	O3	O4	C5	H6	H7	H8
N1		1.2118	1.2035	1.3833	2.3594	3.2263	2.6565	2.6565
O2	1.2118		2.1809	2.2236	2.5313	3.5898	2.5274	2.5274
O3	1.2035	2.1809		2.1608	3.4335	4.1474	3.7704	3.7704
O4	1.3833	2.2236	2.1608		1.4402	1.9886	2.0925	2.0925
C5	2.3594	2.5313	3.4335	1.4402		1.0891	1.0903	1.0903
H6	3.2263	3.5898	4.1474	1.9886	1.0891		1.7956	1.7956
H7	2.6565	2.5274	3.7704	2.0925	1.0903	1.7956		1.7898
H8	2.6565	2.5274	3.7704	2.0925	1.0903	1.7956	1.7898

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O4	C5	113.349	O2	N1	O3	129.101
O2	N1	O4	117.781	O3	N1	O4	113.118
O4	C5	H6	102.783	O4	C5	H7	110.804
O4	C5	H8	110.804	H6	C5	H7	110.957
H6	C5	H8	110.957	H7	C5	H8	110.332

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

using model chemistry: MP3/6-31G*

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 CH3NO3 (Methyl nitrate)

using model chemistry: MP3/6-31G*

States and conformations

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