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	hartrees
Energy at 0K	-228.370217
Energy at 298.15K	-228.375090
HF Energy	-227.759028
Nuclear repulsion energy	119.157746

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3677	3468	66.43
2	A'	3064	2889	63.38
3	A'	3044	2871	41.99
4	A'	1778	1677	70.12
5	A'	1554	1466	8.25
6	A'	1492	1407	88.61
7	A'	1433	1351	11.56
8	A'	1339	1263	54.59
9	A'	1158	1092	68.34
10	A'	903	852	47.16
11	A'	773	729	10.19
12	A'	314	296	22.03
13	A"	3097	2920	25.24
14	A"	1271	1198	3.77
15	A"	1142	1077	0.37
16	A"	757	714	0.10
17	A"	392	369	98.85
18	A"	157	149	12.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	-0.936	0.000
C2	-0.933	0.268	0.000
O3	1.356	-0.578	0.000
O4	-0.515	1.411	0.000
H5	1.362	0.394	0.000
H6	-0.236	-1.547	0.884
H7	-0.236	-1.547	-0.884
H8	-2.021	0.046	0.000

	C1	C2	O3	O4	H5	H6	H7	H8
C1		1.5235	1.4029	2.4034	1.9040	1.0997	1.0997	2.2470
C2	1.5235		2.4408	1.2176	2.2985	2.1354	2.1354	1.1098
O3	1.4029	2.4408		2.7310	0.9723	2.0626	2.0626	3.4343
O4	2.4034	1.2176	2.7310		2.1344	3.0997	3.0997	2.0325
H5	1.9040	2.2985	0.9723	2.1344		2.6647	2.6647	3.4003
H6	1.0997	2.1354	2.0626	3.0997	2.6647		1.7679	2.5504
H7	1.0997	2.1354	2.0626	3.0997	2.6647	1.7679		2.5504
H8	2.2470	1.1098	3.4343	2.0325	3.4003	2.5504	2.5504

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	122.126	C1	C2	H8	116.262
C1	O3	H5	105.116	C2	C1	O3	112.975
C2	C1	H6	107.895	C2	C1	H7	107.895
O3	C1	H6	110.428	O3	C1	H7	110.428
O4	C2	H8	121.611	H6	C1	H7	106.992

All results from a given calculation for CHOCH₂OH (hydroxy acetaldehyde)

using model chemistry: MP2/6-31G*

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 CHOCH2OH (hydroxy acetaldehyde)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for CHOCH₂OH (hydroxy acetaldehyde)