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	hartrees
Energy at 0K	-340.863580
Energy at 298.15K
HF Energy	-340.863580
Nuclear repulsion energy	226.956736

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3255	3235	0.32
2	A₁	1848	1837	618.43
3	A₁	1618	1608	5.01
4	A₁	1142	1135	117.02
5	A₁	1077	1071	18.76
6	A₁	854	849	36.67
7	A₁	713	709	2.59
8	A₂	769	765	0.00
9	A₂	564	561	0.00
10	B₁	734	730	0.05
11	B₁	675	671	84.00
12	B₁	241	239	0.42
13	B₂	3229	3210	8.23
14	B₂	1304	1296	19.77
15	B₂	1059	1052	74.60
16	B₂	973	967	44.00
17	B₂	860	855	0.51
18	B₂	496	493	0.04

Atom	y (Å)	z (Å)
C1	0.000	0.793
O2	0.000	1.996
O3	1.122	-0.025
O4	-1.122	-0.025
C5	0.672	-1.339
C6	-0.672	-1.339
H7	1.423	-2.128
H8	-1.423	-2.128

	C1	O2	O3	O4	C5	C6	H7	H8
C1		1.2033	1.3878	1.3878	2.2354	2.2354	3.2493	3.2493
O2	1.2033		2.3110	2.3110	3.4023	3.4023	4.3630	4.3630
O3	1.3878	2.3110		2.2435	1.3894	2.2243	2.1253	3.3021
O4	1.3878	2.3110	2.2435		2.2243	1.3894	3.3021	2.1253
C5	2.2354	3.4023	1.3894	2.2243		1.3447	1.0893	2.2394
C6	2.2354	3.4023	2.2243	1.3894	1.3447		2.2394	1.0893
H7	3.2493	4.3630	2.1253	3.3021	1.0893	2.2394		2.8469
H8	3.2493	4.3630	3.3021	2.1253	2.2394	1.0893	2.8469

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	C5	107.201	C1	O4	C6	107.201
O2	C1	O3	126.072	O2	C1	O4	126.072
O3	C1	O4	107.855	O3	C5	C6	108.871
O3	C5	H7	117.539	O4	C6	C5	108.871
O4	C6	H8	117.539	C5	C6	H8	133.590
C6	C5	H7	133.590

All results from a given calculation for C₃H₂O₃ (vinylene carbonate)

using model chemistry: PBEPBEultrafine/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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Number	Element	Mulliken
1	C	0.695
2	O	-0.466
3	O	-0.431
4	O	-0.431
5	C	0.726
6	C	0.726
7	H	-0.409
8	H	-0.409

<r²>	116.759
(<r²>)^1/2	10.806

All results from a given calculation for C3H2O3 (vinylene carbonate)

using model chemistry: PBEPBEultrafine/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₃H₂O₃ (vinylene carbonate)