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	hartrees
Energy at 0K	-192.569770
Energy at 298.15K	-192.576646
Nuclear repulsion energy	123.661089

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3248	3115	17.80
2	A	3176	3046	30.71
3	A	3159	3029	7.78
4	A	3155	3025	13.58
5	A	3141	3012	21.28
6	A	3064	2938	15.87
7	A	1524	1461	6.23
8	A	1488	1427	6.28
9	A	1471	1411	4.80
10	A	1439	1380	16.69
11	A	1384	1327	3.04
12	A	1283	1231	3.15
13	A	1183	1135	0.69
14	A	1153	1106	2.89
15	A	1141	1094	0.96
16	A	1107	1061	5.43
17	A	1029	987	7.55
18	A	959	920	9.01
19	A	896	860	1.38
20	A	844	809	46.30
21	A	750	720	7.00
22	A	405	389	4.04
23	A	366	351	4.33
24	A	212	203	0.42

Atom	x (Å)	y (Å)	z (Å)
O1	0.834	-0.803	-0.238
C2	-1.510	0.095	-0.152
H3	-1.398	0.311	-1.225
H4	-2.078	-0.842	-0.040
H5	-2.088	0.907	0.319
C6	-0.156	-0.028	0.497
H7	-0.148	-0.242	1.573
C8	1.038	0.630	-0.065
H9	0.936	1.215	-0.985
H10	1.876	0.893	0.587

	O1	C2	H3	H4	H5	C6	H7	C8	H9	H10
O1		2.5118	2.6831	2.9183	3.4307	1.4564	2.1347	1.4579	2.1541	2.1550
C2	2.5118		1.1001	1.1011	1.1023	1.5068	2.2241	2.6056	2.8162	3.5568
H3	2.6831	1.1001		1.7874	1.7932	2.1504	3.1144	2.7174	2.5145	3.7875
H4	2.9183	1.1011	1.7874		1.7859	2.1547	2.5857	3.4461	3.7687	4.3629
H5	3.4307	1.1023	1.7932	1.7859		2.1533	2.5799	3.1616	3.3071	3.9727
C6	1.4564	1.5068	2.1504	2.1547	2.1533		1.0969	1.4752	2.2213	2.2332
H7	2.1347	2.2241	3.1144	2.5857	2.5799	1.0969		2.2026	3.1370	2.5213
C8	1.4579	2.6056	2.7174	3.4461	3.1616	1.4752	2.2026		1.0948	1.0939
H9	2.1541	2.8162	2.5145	3.7687	3.3071	2.2213	3.1370	1.0948		1.8599
H10	2.1550	3.5568	3.7875	4.3629	3.9727	2.2332	2.5213	1.0939	1.8599

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C6	C2	115.904	O1	C6	H7	112.695
O1	C6	C8	59.639	O1	C8	C6	59.540
O1	C8	H9	114.347	O1	C8	H10	114.488
C2	C6	H7	116.459	C2	C6	C8	121.795
H3	C2	H4	108.582	H3	C2	H5	109.015
H3	C2	C6	110.179	H4	C2	H5	108.288
H4	C2	C6	110.456	H5	C2	C6	110.270
C6	O1	C8	60.822	C6	C8	H9	118.868
C6	C8	H10	120.010	H7	C6	C8	117.050
H9	C8	H10	116.377

All results from a given calculation for C₃H₆O (Propylene oxide)

using model chemistry: MP2/aug-cc-pVDZ

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 C3H6O (Propylene oxide)

using model chemistry: MP2/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₃H₆O (Propylene oxide)