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	hartrees
Energy at 0K	-155.684097
Energy at 298.15K	-155.689865
HF Energy	-154.943913
Nuclear repulsion energy	109.884208

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3182	3028	9.30
2	A₁	3173	3019	5.75
3	A₁	1847	1758	3.59
4	A₁	1502	1429	0.24
5	A₁	1461	1390	0.79
6	A₁	1079	1027	4.46
7	A₁	1015	966	4.69
8	A₁	754	717	4.85
9	A₂	3241	3084	0.00
10	A₂	1173	1116	0.00
11	A₂	960	913	0.00
12	A₂	620	590	0.00
13	B₁	3258	3100	4.77
14	B₁	1101	1048	2.96
15	B₁	946	900	40.84
16	B₁	753	716	2.22
17	B₁	290	276	4.59
18	B₂	3254	3095	5.37
19	B₂	3162	3009	7.23
20	B₂	1459	1388	2.74
21	B₂	1153	1097	6.60
22	B₂	1050	999	0.63
23	B₂	923	879	16.18
24	B₂	349	332	0.29

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.649
C2	0.000	0.000	0.305
H3	0.000	0.895	2.167
H4	0.000	-0.895	2.167
C5	0.000	0.747	-0.891
C6	0.000	-0.747	-0.891
H7	0.917	0.928	-1.343
H8	-0.917	0.928	-1.343
H9	-0.917	-0.928	-1.343
H10	0.917	-0.928	-1.343

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10
C1		1.3438	1.0338	1.0338	2.6479	2.6479	3.2643	3.2643	3.2643	3.2643
C2	1.3438		2.0654	2.0654	1.4106	1.4106	2.1022	2.1022	2.1022	2.1022
H3	1.0338	2.0654		1.7896	3.0615	3.4710	3.6280	3.6280	4.0599	4.0599
H4	1.0338	2.0654	1.7896		3.4710	3.0615	4.0599	4.0599	3.6280	3.6280
C5	2.6479	1.4106	3.0615	3.4710		1.4947	1.0382	1.0382	1.9625	1.9625
C6	2.6479	1.4106	3.4710	3.0615	1.4947		1.9625	1.9625	1.0382	1.0382
H7	3.2643	2.1022	3.6280	4.0599	1.0382	1.9625		1.8341	2.6090	1.8555
H8	3.2643	2.1022	3.6280	4.0599	1.0382	1.9625	1.8341		1.8555	2.6090
H9	3.2643	2.1022	4.0599	3.6280	1.9625	1.0382	2.6090	1.8555		1.8341
H10	3.2643	2.1022	4.0599	3.6280	1.9625	1.0382	1.8555	2.6090	1.8341

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C5	148.007	C1	C2	C6	148.007
C2	C1	H3	120.054	C2	C1	H4	120.054
C2	C5	C6	58.007	C2	C5	H7	117.474
C2	C5	H8	117.474	C2	C6	C5	58.007
C2	C6	H9	117.474	C2	C6	H10	117.474
H3	C1	H4	119.891	C5	C2	C6	63.985
C5	C6	H9	100.005	C5	C6	H10	100.005
C6	C5	H7	100.005	C6	C5	H8	100.005
H7	C5	H8	124.086	H9	C6	H10	124.086

All results from a given calculation for C₄H₆ (Methylenecyclopropane)

using model chemistry: MP2=FULL/aug-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: MP2=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₄H₆ (Methylenecyclopropane)