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	hartrees
Energy at 0K	-267.616241
Energy at 298.15K	-267.624486
HF Energy	-266.799994
Nuclear repulsion energy	194.277012

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3191	3004	20.78
2	A	3091	2910	0.76
3	A	3084	2903	126.19
4	A	1619	1524	8.42
5	A	1576	1484	3.45
6	A	1431	1347	14.74
7	A	1287	1211	4.59
8	A	1242	1169	65.60
9	A	1193	1123	62.97
10	A	1175	1106	95.51
11	A	995	937	0.09
12	A	982	924	8.66
13	A	740	697	0.35
14	A	285	268	0.73
15	A	3197	3009	42.47
16	A	3134	2950	73.90
17	A	3095	2913	71.45
18	A	1570	1478	0.49
19	A	1473	1387	14.55
20	A	1378	1297	0.02
21	A	1257	1183	4.28
22	A	1186	1116	21.64
23	A	1123	1057	38.67
24	A	992	934	44.51
25	A	934	879	28.08
26	A	653	615	5.19
27	A	13	12	19.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.206
C2	-0.310	0.693	-0.945
C3	0.310	-0.693	-0.945
O4	0.000	1.149	0.372
O5	0.000	-1.149	0.372
H6	0.896	0.043	1.832
H7	-0.896	-0.043	1.832
H8	-1.393	0.641	-1.102
H9	1.393	-0.641	-1.102
H10	-0.131	-1.388	-1.657
H11	0.131	1.388	-1.657

	C1	C2	C3	O4	O5	H6	H7	H8	H9	H10	H11
C1		2.2813	2.2813	1.4203	1.4203	1.0940	1.0940	2.7709	2.7709	3.1849	3.1849
C2	2.2813		1.5190	1.4276	2.2860	3.0967	2.9320	1.0953	2.1689	2.2069	1.0886
C3	2.2813	1.5190		2.2860	1.4276	2.9320	3.0967	2.1689	1.0953	1.0886	2.2069
O4	1.4203	1.4276	2.2860		2.2988	2.0395	2.0873	2.0907	2.7048	3.2515	2.0474
O5	1.4203	2.2860	1.4276	2.2988		2.0873	2.0395	2.7048	2.0907	2.0474	3.2515
H6	1.0940	3.0967	2.9320	2.0395	2.0873		1.7947	3.7690	3.0531	3.9088	3.8169
H7	1.0940	2.9320	3.0967	2.0873	2.0395	1.7947		3.0531	3.7690	3.8169	3.9088
H8	2.7709	1.0953	2.1689	2.0907	2.7048	3.7690	3.0531		3.0661	2.4523	1.7861
H9	2.7709	2.1689	1.0953	2.7048	2.0907	3.0531	3.7690	3.0661		1.7861	2.4523
H10	3.1849	2.2069	1.0886	3.2515	2.0474	3.9088	3.8169	2.4523	1.7861		2.7880
H11	3.1849	1.0886	2.2069	2.0474	3.2515	3.8169	3.9088	1.7861	2.4523	2.7880

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C2	106.456	C1	O5	C3	106.456
C2	C3	O5	101.707	C2	C3	H9	111.081
C2	C3	H10	114.626	C3	C2	O4	101.707
C3	C2	H8	111.081	C3	C2	H11	114.626
O4	C1	O5	108.048	O4	C1	H6	107.711
O4	C1	H7	111.581	O4	C2	H8	111.249
O4	C2	H11	108.164	O5	C1	H6	111.581
O5	C1	H7	107.711	O5	C3	H9	111.249
O5	C3	H10	108.164	H6	C1	H7	110.221
H8	C2	H11	109.749	H9	C3	H10	109.749

All results from a given calculation for C₃H₆O₂ (1,3-Dioxolane)

using model chemistry: QCISD/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 C3H6O2 (1,3-Dioxolane)

using model chemistry: QCISD/6-31G**

States and conformations

All results from a given calculation for C₃H₆O₂ (1,3-Dioxolane)