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	hartrees
Energy at 0K	-115.573507
Energy at 298.15K	-115.575260
HF Energy	-115.197561
Nuclear repulsion energy	57.888758

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3389	3174	0.27
2	A'	3181	2979	55.88
3	A'	1668	1562	0.30
4	A'	1291	1209	9.94
5	A'	1065	998	12.66
6	A'	964	902	5.18
7	A'	592	554	61.19
8	A"	8108	7594	776604.00
9	A"	3145	2945	2640.76
10	A"	1051	984	12.29
11	A"	1021	956	0.41
12	A"	859	804	0.13

Atom	x (Å)	y (Å)	z (Å)
C1	-0.037	0.888	0.000
H2	0.747	1.641	0.000
C3	-0.037	-0.418	0.661
C4	-0.037	-0.418	-0.661
H5	-0.039	-0.979	1.577
H6	-0.039	-0.979	-1.577

	C1	H2	C3	C4	H5	H6
C1		1.0874	1.4638	1.4638	2.4444	2.4444
H2	1.0874		2.3004	2.3004	3.1579	3.1579
C3	1.4638	2.3004		1.3215	1.0746	2.3069
C4	1.4638	2.3004	1.3215		2.3069	1.0746
H5	2.4444	3.1579	1.0746	2.3069		3.1535
H6	2.4444	3.1579	2.3069	1.0746	3.1535

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	63.166	C1	C3	H5	148.351
C1	C4	C3	63.166	C1	C4	H6	148.351
H2	C1	C3	128.155	H2	C1	C4	128.155
C3	C1	C4	53.667	C3	C4	H6	148.482
C4	C3	H5	148.482

All results from a given calculation for C₃H₃ (cyclopropenyl radical)

using model chemistry: MP2/6-31G**

States and conformations

Conformer 1 (D3H)

Conformer 2 (CS)

	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 C3H3 (cyclopropenyl radical)

using model chemistry: MP2/6-31G**

States and conformations

Conformer 1 (D3H)

Conformer 2 (CS)

All results from a given calculation for C₃H₃ (cyclopropenyl radical)