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	hartrees
Energy at 0K	-268.831778
Energy at 298.15K	-268.841619
HF Energy	-267.995193
Nuclear repulsion energy	195.006287

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3873	3638	35.90
2	A	3818	3586	56.11
3	A	3236	3039	14.40
4	A	3224	3028	27.12
5	A	3209	3014	13.96
6	A	3125	2935	25.32
7	A	3116	2926	29.06
8	A	3051	2865	60.58
9	A	1548	1454	3.58
10	A	1541	1447	4.33
11	A	1533	1440	3.70
12	A	1477	1387	11.27
13	A	1452	1364	22.51
14	A	1414	1328	9.48
15	A	1401	1315	20.31
16	A	1371	1287	19.53
17	A	1308	1228	53.74
18	A	1247	1171	13.43
19	A	1201	1128	14.16
20	A	1114	1046	45.19
21	A	1102	1035	8.98
22	A	1066	1001	118.79
23	A	970	911	4.36
24	A	943	886	22.78
25	A	872	819	16.04
26	A	539	506	46.88
27	A	506	475	144.19
28	A	489	459	4.62
29	A	369	346	11.08
30	A	298	280	87.53
31	A	254	238	6.02
32	A	235	221	0.55
33	A	156	146	6.66

Atom	x (Å)	y (Å)	z (Å)
O1	-0.454	1.377	-0.156
H2	0.469	1.673	-0.139
O3	1.946	-0.039	0.008
H4	2.207	-0.208	0.923
C5	0.710	-0.724	-0.247
H6	0.614	-0.751	-1.331
H7	0.740	-1.747	0.135
C8	-0.459	0.040	0.345
H9	-0.346	0.058	1.438
C10	-1.792	-0.576	-0.018
H11	-1.901	-0.611	-1.100
H12	-1.873	-1.586	0.382
H13	-2.600	0.026	0.390

	O1	H2	O3	H4	C5	H6	H7	C8	H9	C10	H11	H12	H13
O1		0.9695	2.7916	3.2795	2.4034	2.6551	3.3571	1.4269	2.0712	2.3710	2.6340	3.3290	2.5931
H2	0.9695		2.2665	2.7726	2.4115	2.7054	3.4422	1.9393	2.3997	3.1912	3.4291	4.0472	3.5223
O3	2.7916	2.2665		0.9658	1.4351	2.0181	2.0948	2.4299	2.7031	3.7760	4.0442	4.1372	4.5621
H4	3.2795	2.7726	0.9658		1.9678	2.8122	2.2676	2.7391	2.6178	4.1239	4.5967	4.3398	4.8414
C5	2.4034	2.4115	1.4351	1.9678		1.0884	1.0929	1.5172	2.1366	2.5169	2.7499	2.7953	3.4533
H6	2.6551	2.7054	2.0181	2.8122	1.0884		1.7763	2.1413	3.0398	2.7462	2.5296	3.1331	3.7273
H7	3.3571	3.4422	2.0948	2.2676	1.0929	1.7763		2.1628	2.4772	2.7933	3.1290	2.6293	3.7898
C8	1.4269	1.9393	2.4299	2.7391	1.5172	2.1413	2.1628		1.0990	1.5123	2.1429	2.1555	2.1410
H9	2.0712	2.3997	2.7031	2.6178	2.1366	3.0398	2.4772	1.0990		2.1471	3.0509	2.4797	2.4854
C10	2.3710	3.1912	3.7760	4.1239	2.5169	2.7462	2.7933	1.5123	2.1471		1.0887	1.0895	1.0873
H11	2.6340	3.4291	4.0442	4.5967	2.7499	2.5296	3.1290	2.1429	3.0509	1.0887		1.7749	1.7650
H12	3.3290	4.0472	4.1372	4.3398	2.7953	3.1331	2.6293	2.1555	2.4797	1.0895	1.7749		1.7689
H13	2.5931	3.5223	4.5621	4.8414	3.4533	3.7273	3.7898	2.1410	2.4854	1.0873	1.7650	1.7689

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C8	C5	109.405	O1	C8	H9	109.478
O1	C8	C10	107.512	H2	O1	C8	106.478
O3	C5	H6	105.379	O3	C5	H7	111.197
O3	C5	C8	110.750	H4	O3	C5	108.499
C5	C8	H9	108.450	C5	C8	C10	112.364
H6	C5	H7	109.044	H6	C5	C8	109.427
H7	C5	C8	110.874	C8	C10	H11	109.878
C8	C10	H12	110.839	C8	C10	H13	109.811
H9	C8	C10	109.603	H11	C10	H12	109.141
H11	C10	H13	108.415	H12	C10	H13	108.709

All results from a given calculation for C₃H₈O₂ (Propylene glycol)

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 C3H8O2 (Propylene glycol)

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

States and conformations

All results from a given calculation for C₃H₈O₂ (Propylene glycol)