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	hartrees
Energy at 0K	-155.633897
Energy at 298.15K	-155.639702
HF Energy	-154.942359
Nuclear repulsion energy	109.389385

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3156	3015	10.47
2	A₁	3148	3008	9.55
3	A₁	1855	1773	3.69
4	A₁	1511	1443	0.40
5	A₁	1466	1401	0.54
6	A₁	1075	1027	2.01
7	A₁	1060	1013	4.75
8	A₁	752	718	5.67
9	A₂	3224	3080	0.00
10	A₂	1188	1135	0.00
11	A₂	968	925	0.00
12	A₂	630	602	0.00
13	B₁	3236	3092	12.46
14	B₁	1113	1064	2.53
15	B₁	935	893	39.87
16	B₁	765	731	1.17
17	B₁	293	280	4.40
18	B₂	3239	3095	9.08
19	B₂	3144	3004	12.96
20	B₂	1471	1406	1.55
21	B₂	1163	1111	6.13
22	B₂	1094	1046	1.16
23	B₂	920	879	14.34
24	B₂	356	341	0.23

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.652
C2	0.000	0.000	0.307
H3	0.000	0.895	2.170
H4	0.000	-0.895	2.170
C5	0.000	0.747	-0.893
C6	0.000	-0.747	-0.893
H7	0.917	0.927	-1.345
H8	-0.917	0.927	-1.345
H9	-0.917	-0.927	-1.345
H10	0.917	-0.927	-1.345

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10
C1		1.3449	1.0343	1.0343	2.6518	2.6518	3.2685	3.2685	3.2685	3.2685
C2	1.3449		2.0672	2.0672	1.4132	1.4132	2.1049	2.1049	2.1049	2.1049
H3	1.0343	2.0672		1.7898	3.0666	3.4753	3.6333	3.6333	4.0645	4.0645
H4	1.0343	2.0672	1.7898		3.4753	3.0666	4.0645	4.0645	3.6333	3.6333
C5	2.6518	1.4132	3.0666	3.4753		1.4940	1.0387	1.0387	1.9621	1.9621
C6	2.6518	1.4132	3.4753	3.0666	1.4940		1.9621	1.9621	1.0387	1.0387
H7	3.2685	2.1049	3.6333	4.0645	1.0387	1.9621		1.8350	2.6089	1.8545
H8	3.2685	2.1049	3.6333	4.0645	1.0387	1.9621	1.8350		1.8545	2.6089
H9	3.2685	2.1049	4.0645	3.6333	1.9621	1.0387	2.6089	1.8545		1.8350
H10	3.2685	2.1049	4.0645	3.6333	1.9621	1.0387	1.8545	2.6089	1.8350

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C5	148.088	C1	C2	C6	148.088
C2	C1	H3	120.091	C2	C1	H4	120.091
C2	C5	C6	58.088	C2	C5	H7	117.481
C2	C5	H8	117.481	C2	C6	C5	58.088
C2	C6	H9	117.481	C2	C6	H10	117.481
H3	C1	H4	119.817	C5	C2	C6	63.824
C5	C6	H9	99.993	C5	C6	H10	99.993
C6	C5	H7	99.993	C6	C5	H8	99.993
H7	C5	H8	124.080	H9	C6	H10	124.080

All results from a given calculation for C₄H₆ (Methylenecyclopropane)

using model chemistry: QCISD/cc-pVTZ

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 C4H6 (Methylenecyclopropane)

using model chemistry: QCISD/cc-pVTZ

States and conformations

All results from a given calculation for C₄H₆ (Methylenecyclopropane)