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	hartrees
Energy at 0K	-303.291469
Energy at 298.15K	-303.297927
HF Energy	-302.419511
Nuclear repulsion energy	191.367476

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3150	3022
2	A'	3076	2951
3	A'	1556	1493
4	A'	1365	1309
5	A'	1253	1202
6	A'	1019	978
7	A'	955	916
8	A'	877	841
9	A'	853	818
10	A'	689	661
11	A'	409	393
12	A"	3133	3006
13	A"	3066	2941
14	A"	1539	1476
15	A"	1361	1306
16	A"	1240	1189
17	A"	1168	1121
18	A"	1034	992
19	A"	736	706
20	A"	667	640
21	A"	110	105

Atom	x (Å)	y (Å)	z (Å)
O1	-0.605	-1.053	0.000
O2	0.150	-0.490	1.125
O3	0.150	-0.490	-1.125
C4	0.150	0.901	0.777
C5	0.150	0.901	-0.777
H6	1.058	1.325	1.221
H7	1.058	1.325	-1.221
H8	-0.742	1.403	1.174
H9	-0.742	1.403	-1.174

	O1	O2	O3	C4	C5	H6	H7	H8	H9
O1		1.4665	1.4665	2.2337	2.2337	3.1480	3.1480	2.7256	2.7256
O2	1.4665		2.2493	1.4337	2.3565	2.0324	3.1019	2.0941	3.1091
O3	1.4665	2.2493		2.3565	1.4337	3.1019	2.0324	3.1091	2.0941
C4	2.2337	1.4337	2.3565		1.5549	1.0960	2.2354	1.0983	2.2038
C5	2.2337	2.3565	1.4337	1.5549		2.2354	1.0960	2.2038	1.0983
H6	3.1480	2.0324	3.1019	1.0960	2.2354		2.4413	1.8026	2.9969
H7	3.1480	3.1019	2.0324	2.2354	1.0960	2.4413		2.9969	1.8026
H8	2.7256	2.0941	3.1091	1.0983	2.2038	1.8026	2.9969		2.3479
H9	2.7256	3.1091	2.0941	2.2038	1.0983	2.9969	1.8026	2.3479

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	O2	C4	100.733	O1	O3	C5	100.733
O2	O1	O3	100.149	O2	C4	C5	104.014
O2	C4	H6	106.145	O2	C4	H8	110.897
O3	C5	C4	104.014	O3	C5	H7	106.145
O3	C5	H9	110.897	C4	C5	H7	113.854
C4	C5	H9	111.163	C5	C4	H6	113.854
C5	C4	H8	111.163	H6	C4	H8	110.467
H7	C5	H9	110.467

All results from a given calculation for C₂H₄O₃ (1,2,3-trioxolane)

using model chemistry: QCISD(T)/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 C2H4O3 (1,2,3-trioxolane)

using model chemistry: QCISD(T)/6-31G*

States and conformations

All results from a given calculation for C₂H₄O₃ (1,2,3-trioxolane)