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	hartrees
Energy at 0K	-154.380007
Energy at 298.15K	-154.385887
HF Energy	-154.016721
Nuclear repulsion energy	108.355142

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3189	3045	4.99
2	A₁	3166	3023	11.04
3	A₁	1821	1739	0.19
4	A₁	1565	1494	0.01
5	A₁	1537	1468	0.22
6	A₁	1121	1070	11.66
7	A₁	1000	955	1.83
8	A₁	701	669	5.50
9	A₂	3269	3121	0.00
10	A₂	1207	1152	0.00
11	A₂	1018	972	0.00
12	A₂	658	628	0.00
13	B₁	3283	3134	11.21
14	B₁	1168	1115	0.11
15	B₁	953	910	45.10
16	B₁	802	765	1.08
17	B₁	320	306	5.52
18	B₂	3246	3100	11.51
19	B₂	3184	3040	6.77
20	B₂	1543	1473	0.93
21	B₂	1189	1136	12.97
22	B₂	1143	1091	4.14
23	B₂	899	858	10.07
24	B₂	383	365	0.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.647
C2	0.000	0.000	0.323
H3	0.000	0.925	2.217
H4	0.000	-0.925	2.217
C5	0.000	0.788	-0.940
C6	0.000	-0.788	-0.940
H7	0.917	1.281	-1.245
H8	-0.917	1.281	-1.245
H9	-0.917	-1.281	-1.245
H10	0.917	-1.281	-1.245

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10
C1		1.3237	1.0868	1.0868	2.7039	2.7039	3.2930	3.2930	3.2930	3.2930
C2	1.3237		2.1079	2.1079	1.4884	1.4884	2.2226	2.2226	2.2226	2.2226
H3	1.0868	2.1079		1.8503	3.1600	3.5917	3.5991	3.5991	4.2064	4.2064
H4	1.0868	2.1079	1.8503		3.5917	3.1600	4.2064	4.2064	3.5991	3.5991
C5	2.7039	1.4884	3.1600	3.5917		1.5751	1.0847	1.0847	2.2829	2.2829
C6	2.7039	1.4884	3.5917	3.1600	1.5751		2.2829	2.2829	1.0847	1.0847
H7	3.2930	2.2226	3.5991	4.2064	1.0847	2.2829		1.8331	3.1501	2.5618
H8	3.2930	2.2226	3.5991	4.2064	1.0847	2.2829	1.8331		2.5618	3.1501
H9	3.2930	2.2226	4.2064	3.5991	2.2829	1.0847	3.1501	2.5618		1.8331
H10	3.2930	2.2226	4.2064	3.5991	2.2829	1.0847	2.5618	3.1501	1.8331

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C5	148.054	C1	C2	C6	148.054
C2	C1	H3	121.654	C2	C1	H4	121.654
C2	C5	C6	58.054	C2	C5	H7	118.645
C2	C5	H8	118.645	C2	C6	C5	58.054
C2	C6	H9	118.645	C2	C6	H10	118.645
H3	C1	H4	116.692	C5	C2	C6	63.892
C5	C6	H9	117.053	C5	C6	H10	117.053
C6	C5	H7	117.053	C6	C5	H8	117.053
H7	C5	H8	115.340	H9	C6	H10	115.340

All results from a given calculation for C₄H₆ (Methylenecyclopropane)

using model chemistry: MP2=FULL/3-21G

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: MP2=FULL/3-21G

States and conformations

All results from a given calculation for C₄H₆ (Methylenecyclopropane)