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	hartrees
Energy at 0K	-242.781530
Energy at 298.15K
HF Energy	-242.242377
Nuclear repulsion energy	118.571147

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3173	3077
2	A'	3080	2987
3	A'	1555	1508
4	A'	1431	1387
5	A'	1175	1139
6	A'	1134	1099
7	A'	771	748
8	A'	575	557
9	A'	503	488
10	A"	3199	3103
11	A"	1569	1521
12	A"	1501	1456
13	A"	1098	1065
14	A"	407	394
15	A"	34i	32i

Atom	x (Å)	y (Å)	z (Å)
C1	0.003	-1.364	0.000
N2	-0.016	0.168	0.000
H3	1.052	-1.679	0.000
H4	-0.508	-1.683	0.910
H5	-0.508	-1.683	-0.910
O6	0.003	0.753	-1.179
O7	0.003	0.753	1.179

	C1	N2	H3	H4	H5	O6	O7
C1		1.5320	1.0948	1.0914	1.0914	2.4238	2.4238
N2	1.5320		2.1335	2.1201	2.1201	1.3167	1.3167
H3	1.0948	2.1335		1.8059	1.8059	2.8998	2.8998
H4	1.0914	2.1201	1.8059		1.8200	3.2498	2.5039
H5	1.0914	2.1201	1.8059	1.8200		2.5039	3.2498
O6	2.4238	1.3167	2.8998	3.2498	2.5039		2.3583
O7	2.4238	1.3167	2.8998	2.5039	3.2498	2.3583

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O6	116.398	C1	N2	O7	116.398
N2	C1	H3	107.459	N2	C1	H4	106.624
N2	C1	H5	106.624	H3	C1	H4	111.386
H3	C1	H5	111.386	H4	C1	H5	112.972
O6	N2	O7	127.146

All results from a given calculation for CH₃NO₂ (Methane, nitro-)

using model chemistry: MP4/3-21G

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 CH3NO2 (Methane, nitro-)

using model chemistry: MP4/3-21G

States and conformations

All results from a given calculation for CH₃NO₂ (Methane, nitro-)