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	hartrees
Energy at 0K	-116.434693
Energy at 298.15K	-116.437950
HF Energy	-115.868970
Nuclear repulsion energy	64.005008

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3345	3345	0.47
2	A₁	3098	3098	55.08
3	A₁	1729	1729	17.87
4	A₁	1551	1551	1.04
5	A₁	1179	1179	0.02
6	A₁	946	946	4.00
7	A₂	1040	1040	0.00
8	A₂	888	888	0.00
9	B₁	3168	3168	34.61
10	B₁	1134	1134	2.15
11	B₁	624	624	84.06
12	B₂	3299	3299	0.84
13	B₂	1101	1101	25.48
14	B₂	1061	1061	28.55
15	B₂	816	816	16.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.861
C2	0.000	0.646	-0.499
C3	0.000	-0.646	-0.499
H4	0.000	1.572	-1.036
H5	0.000	-1.572	-1.036
H6	0.910	0.000	1.449
H7	-0.910	0.000	1.449

	C1	C2	C3	H4	H5	H6	H7
C1		1.5060	1.5060	2.4639	2.4639	1.0832	1.0832
C2	1.5060		1.2916	1.0706	2.2821	2.2453	2.2453
C3	1.5060	1.2916		2.2821	1.0706	2.2453	2.2453
H4	2.4639	1.0706	2.2821		3.1446	3.0782	3.0782
H5	2.4639	2.2821	1.0706	3.1446		3.0782	3.0782
H6	1.0832	2.2453	2.2453	3.0782	3.0782		1.8195
H7	1.0832	2.2453	2.2453	3.0782	3.0782	1.8195

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.607	C1	C2	H4	145.467
C1	C3	C2	64.607	C1	C3	H5	145.467
C2	C1	C3	50.785	C2	C1	H6	119.366
C2	C1	H7	119.366	C2	C3	H5	149.926
C3	C1	H6	119.366	C3	C1	H7	119.366
C3	C2	H4	149.926	H6	C1	H7	114.248

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: CCSD=FULL/Def2TZVPP

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 C3H4 (cyclopropene)

using model chemistry: CCSD=FULL/Def2TZVPP

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)