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	hartrees
Energy at 0K	-116.317050
Energy at 298.15K	-116.320362
HF Energy	-115.869531
Nuclear repulsion energy	64.320793

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3416	3416	0.81
2	A₁	3160	3160	60.13
3	A₁	1793	1793	18.40
4	A₁	1586	1586	1.42
5	A₁	1211	1211	0.00
6	A₁	969	969	3.98
7	A₂	1063	1063	0.00
8	A₂	924	924	0.00
9	B₁	3230	3230	37.50
10	B₁	1158	1158	2.45
11	B₁	648	648	89.29
12	B₂	3368	3368	1.68
13	B₂	1134	1134	25.55
14	B₂	1094	1094	30.09
15	B₂	844	844	18.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.857
C2	0.000	0.641	-0.497
C3	0.000	-0.641	-0.497
H4	0.000	1.565	-1.032
H5	0.000	-1.565	-1.032
H6	0.906	0.000	1.446
H7	-0.906	0.000	1.446

	C1	C2	C3	H4	H5	H6	H7
C1		1.4984	1.4984	2.4531	2.4531	1.0805	1.0805
C2	1.4984		1.2824	1.0675	2.2702	2.2380	2.2380
C3	1.4984	1.2824		2.2702	1.0675	2.2380	2.2380
H4	2.4531	1.0675	2.2702		3.1303	3.0677	3.0677
H5	2.4531	2.2702	1.0675	3.1303		3.0677	3.0677
H6	1.0805	2.2380	2.2380	3.0677	3.0677		1.8114
H7	1.0805	2.2380	2.2380	3.0677	3.0677	1.8114

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.664	C1	C2	H4	145.389
C1	C3	C2	64.664	C1	C3	H5	145.389
C2	C1	C3	50.671	C2	C1	H6	119.530
C2	C1	H7	119.530	C2	C3	H5	149.947
C3	C1	H6	119.530	C3	C1	H7	119.530
C3	C2	H4	149.947	H6	C1	H7	113.906

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: CID/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: CID/Def2TZVPP

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)