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	hartrees
Energy at 0K	-114.775646
Energy at 298.15K	-114.777416
HF Energy	-114.526109
Nuclear repulsion energy	56.996290

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3362	3198	0.57
2	A'	3171	3017	37.93
3	A'	1569	1492	0.15
4	A'	1181	1124	15.06
5	A'	1054	1003	5.82
6	A'	957	910	2.83
7	A'	629	598	96.03
8	A"	5836	5552	206923.90
9	A"	3093	2942	3440.40
10	A"	1086	1034	7.33
11	A"	1030	979	12.82
12	A"	870	828	0.18

Atom	x (Å)	y (Å)	z (Å)
C1	-0.038	0.919	0.000
H2	0.761	1.656	0.000
C3	-0.038	-0.431	0.666
C4	-0.038	-0.431	-0.666
H5	-0.040	-1.002	1.573
H6	-0.040	-1.002	-1.573

	C1	H2	C3	C4	H5	H6
C1		1.0866	1.5050	1.5050	2.4832	2.4832
H2	1.0866		2.3315	2.3315	3.1911	3.1911
C3	1.5050	2.3315		1.3314	1.0726	2.3108
C4	1.5050	2.3315	1.3314		2.3108	1.0726
H5	2.4832	3.1911	1.0726	2.3108		3.1469
H6	2.4832	3.1911	2.3108	1.0726	3.1469

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	63.749	C1	C3	H5	148.434
C1	C4	C3	63.749	C1	C4	H6	148.434
H2	C1	C3	127.475	H2	C1	C4	127.475
C3	C1	C4	52.502	C3	C4	H6	147.816
C4	C3	H5	147.816

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

Conformer 1 (D3H)

Conformer 2 (CS)

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