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	hartrees
Energy at 0K	-192.556259
Energy at 298.15K	-192.563207
HF Energy	-191.922192
Nuclear repulsion energy	124.592210

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3297	3097	19.99
2	A	3234	3037	23.88
3	A	3216	3020	17.24
4	A	3207	3012	12.03
5	A	3193	2999	20.07
6	A	3121	2931	16.51
7	A	1577	1481	5.07
8	A	1546	1452	7.07
9	A	1528	1435	4.95
10	A	1487	1396	19.48
11	A	1443	1355	4.25
12	A	1319	1239	2.44
13	A	1220	1145	0.41
14	A	1194	1121	3.67
15	A	1181	1109	0.66
16	A	1148	1078	6.25
17	A	1065	1000	6.99
18	A	992	932	11.46
19	A	930	873	1.90
20	A	869	816	48.52
21	A	784	736	6.59
22	A	415	390	4.37
23	A	373	350	5.06
24	A	218	205	0.57

Atom	x (Å)	y (Å)	z (Å)
O1	0.829	-0.798	-0.234
C2	-1.502	0.094	-0.151
H3	-1.391	0.307	-1.212
H4	-2.060	-0.834	-0.041
H5	-2.075	0.898	0.312
C6	-0.155	-0.027	0.493
H7	-0.151	-0.235	1.558
C8	1.033	0.624	-0.066
H9	0.934	1.205	-0.975
H10	1.860	0.891	0.578

	O1	C2	H3	H4	H5	C6	H7	C8	H9	H10
O1		2.4973	2.6649	2.8956	3.4067	1.4457	2.1189	1.4465	2.1381	2.1397
C2	2.4973		1.0878	1.0887	1.0899	1.4989	2.2042	2.5912	2.8014	3.5320
H3	2.6649	1.0878		1.7667	1.7723	2.1325	3.0834	2.6994	2.5035	3.7572
H4	2.8956	1.0887	1.7667		1.7672	2.1375	2.5619	3.4195	3.7411	4.3281
H5	3.4067	1.0899	1.7723	1.7672		2.1394	2.5574	3.1427	3.2873	3.9447
C6	1.4457	1.4989	2.1325	2.1375	2.1394		1.0856	1.4648	2.2039	2.2159
H7	2.1189	2.2042	3.0834	2.5619	2.5574	1.0856		2.1859	3.1095	2.5051
C8	1.4465	2.5912	2.6994	3.4195	3.1427	1.4648	2.1859		1.0831	1.0824
H9	2.1381	2.8014	2.5035	3.7411	3.2873	2.2039	3.1095	1.0831		1.8353
H10	2.1397	3.5320	3.7572	4.3281	3.9447	2.2159	2.5051	1.0824	1.8353

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C6	C2	116.006	O1	C6	H7	112.901
O1	C6	C8	59.598	O1	C8	C6	59.543
O1	C8	H9	114.634	O1	C8	H10	114.823
C2	C6	H7	116.128	C2	C6	C8	121.922
H3	C2	H4	108.525	H3	C2	H5	108.949
H3	C2	C6	110.039	H4	C2	H5	108.420
H4	C2	C6	110.388	H5	C2	C6	110.468
C6	O1	C8	60.859	C6	C8	H9	119.003
C6	C8	H10	120.157	H7	C6	C8	117.203
H9	C8	H10	115.886

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

using model chemistry: MP2=FULL/6-31+G**

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=FULL/6-31+G**

States and conformations

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