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	hartrees
Energy at 0K	-264.671351
Energy at 298.15K	-264.675563
HF Energy	-264.136552
Nuclear repulsion energy	157.625591

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3203	3037	4.90
2	A'	3101	2940	0.20
3	A'	3014	2857	87.28
4	A'	1642	1557	8.26
5	A'	1591	1508	20.56
6	A'	1552	1471	18.11
7	A'	1476	1399	34.93
8	A'	1382	1310	3.81
9	A'	1228	1164	28.89
10	A'	1023	970	1.68
11	A'	768	728	13.86
12	A'	577	547	7.34
13	A'	467	443	17.12
14	A'	254	241	18.32
15	A"	3167	3003	2.59
16	A"	1575	1493	12.07
17	A"	1131	1073	4.29
18	A"	975	924	0.02
19	A"	510	483	0.02
20	A"	198	188	13.48
21	A"	89	85	2.36

Atom	x (Å)	y (Å)	z (Å)
C1	-0.861	-0.698	0.000
C2	0.000	0.565	0.000
C3	1.494	0.310	0.000
O4	-0.369	-1.848	0.000
O5	-0.559	1.687	0.000
H6	-1.942	-0.486	0.000
H7	2.030	1.261	0.000
H8	1.770	-0.276	0.883
H9	1.770	-0.276	-0.883

	C1	C2	C3	O4	O5	H6	H7	H8	H9
C1		1.5287	2.5624	1.2512	2.4040	1.1016	3.4928	2.8074	2.8074
C2	1.5287		1.5161	2.4412	1.2538	2.2087	2.1464	2.1495	2.1495
C3	2.5624	1.5161		2.8513	2.4728	3.5280	1.0916	1.0950	1.0950
O4	1.2512	2.4412	2.8513		3.5403	2.0809	3.9272	2.7973	2.7973
O5	2.4040	1.2538	2.4728	3.5403		2.5762	2.6246	3.1719	3.1719
H6	1.1016	2.2087	3.5280	2.0809	2.5762		4.3402	3.8218	3.8218
H7	3.4928	2.1464	1.0916	3.9272	2.6246	4.3402		1.7918	1.7918
H8	2.8074	2.1495	1.0950	2.7973	3.1719	3.8218	1.7918		1.7654
H9	2.8074	2.1495	1.0950	2.7973	3.1719	3.8218	1.7918	1.7654

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	114.612	C1	C2	O5	119.209
C2	C1	O4	122.525	C2	C1	H6	113.225
C2	C3	H7	109.721	C2	C3	H8	109.767
C2	C3	H9	109.767	C3	C2	O5	126.179
O4	C1	H6	124.250	H7	C3	H8	110.057
H7	C3	H9	110.057	H8	C3	H9	107.441

All results from a given calculation for C₃H₄O₂ (Methyl glyoxal)

using model chemistry: MP2=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 C3H4O2 (Methyl glyoxal)

using model chemistry: MP2=FULL/3-21G*

States and conformations

All results from a given calculation for C₃H₄O₂ (Methyl glyoxal)