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	hartrees
Energy at 0K	-242.788203
Energy at 298.15K
HF Energy	-242.242425
Nuclear repulsion energy	118.585663

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3173	3106
2	A'	3080	3015
3	A'	1555	1522
4	A'	1431	1401
5	A'	1175	1150
6	A'	1134	1110
7	A'	771	755
8	A'	575	563
9	A'	503	493
10	A"	3200	3132
11	A"	1569	1535
12	A"	1502	1470
13	A"	1098	1075
14	A"	407	398
15	A"	33i	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		1.5316	1.0946	1.0913	1.0913	2.4233	2.4233
N2	1.5316		2.1332	2.1198	2.1198	1.3167	1.3167
H3	1.0946	2.1332		1.8056	1.8056	2.8994	2.8994
H4	1.0913	2.1198	1.8056		1.8197	3.2495	2.5036
H5	1.0913	2.1198	1.8056	1.8197		2.5036	3.2495
O6	2.4233	1.3167	2.8994	3.2495	2.5036		2.3581
O7	2.4233	1.3167	2.8994	2.5036	3.2495	2.3581

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O6	116.399	C1	N2	O7	116.399
N2	C1	H3	107.469	N2	C1	H4	106.635
N2	C1	H5	106.635	H3	C1	H4	111.376
H3	C1	H5	111.376	H4	C1	H5	112.963
O6	N2	O7	127.143

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

using model chemistry: MP4=FULL/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=FULL/3-21G

States and conformations

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