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	hartrees
Energy at 0K	-155.457537
Energy at 298.15K
HF Energy	-154.880527
Nuclear repulsion energy	108.176577

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3360	3156	0.19	127.43	0.30	0.46
2	A'	3222	3026	14.98	79.50	0.73	0.84
3	A'	3138	2947	64.74	118.62	0.16	0.28
4	A'	3114	2925	24.82	186.81	0.01	0.02
5	A'	1861	1748	12.18	32.21	0.11	0.19
6	A'	1579	1483	7.70	10.79	0.49	0.66
7	A'	1532	1439	9.08	13.22	0.62	0.76
8	A'	1446	1358	0.05	6.73	0.75	0.86
9	A'	1228	1153	3.17	10.28	0.24	0.39
10	A'	1113	1045	1.19	5.10	0.11	0.20
11	A'	1096	1029	41.10	2.76	0.12	0.21
12	A'	1004	943	5.02	9.99	0.19	0.32
13	A'	965	906	14.27	5.83	0.36	0.53
14	A'	688	646	0.57	12.95	0.62	0.77
15	A'	330	310	1.62	1.39	0.74	0.85
16	A"	3216	3021	39.68	97.71	0.75	0.86
17	A"	3200	3006	15.09	77.95	0.75	0.86
18	A"	1523	1430	8.51	9.00	0.75	0.86
19	A"	1151	1081	1.34	0.52	0.75	0.86
20	A"	1062	997	0.00	0.79	0.75	0.86
21	A"	1006	945	1.95	4.10	0.75	0.86
22	A"	673	632	39.88	1.13	0.75	0.86
23	A"	275	258	16.50	0.33	0.75	0.86
24	A"	154	144	0.68	0.24	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.179	0.000
C2	-0.063	-1.327	0.000
C3	1.154	-0.430	0.000
C4	-0.825	1.404	0.000
H5	-0.341	-1.851	0.911
H6	-0.341	-1.851	-0.911
H7	2.227	-0.397	0.000
H8	-0.202	2.296	0.000
H9	-1.470	1.424	-0.878
H10	-1.470	1.424	0.878

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10
C1		1.5077	1.3048	1.4763	2.2515	2.2515	2.3009	2.1258	2.1166	2.1166
C2	1.5077		1.5111	2.8351	1.0872	1.0872	2.4715	3.6253	3.2122	3.2122
C3	1.3048	1.5111		2.6978	2.2545	2.2545	1.0743	3.0443	3.3303	3.3303
C4	1.4763	2.8351	2.6978		3.4143	3.4143	3.5441	1.0882	1.0899	1.0899
H5	2.2515	1.0872	2.2545	3.4143		1.8217	3.0887	4.2480	3.8987	3.4640
H6	2.2515	1.0872	2.2545	3.4143	1.8217		3.0887	4.2480	3.4640	3.8987
H7	2.3009	2.4715	1.0743	3.5441	3.0887	3.0887		3.6267	4.2140	4.2140
H8	2.1258	3.6253	3.0443	1.0882	4.2480	4.2480	3.6267		1.7721	1.7721
H9	2.1166	3.2122	3.3303	1.0899	3.8987	3.4640	4.2140	1.7721		1.7568
H10	2.1166	3.2122	3.3303	1.0899	3.4640	3.8987	4.2140	1.7721	1.7568

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C3	51.218	H1	C2	C6	119.495
C2	C3	C6	24.819	C2	C3	C10	72.321
C2	C6	C3	35.690	C2	C6	H4	49.698
C2	C6	H5	33.090	C3	C2	C6	119.491
C3	C6	H4	52.075	C3	C6	H5	66.170
C3	C10	H7	9.355	C3	C10	H8	65.131
C3	C10	H9	74.707	H4	C6	H5	74.528
C6	C3	C10	86.282	H7	C10	H8	58.765
H7	C10	H9	77.968	H8	C10	H9	60.284

All results from a given calculation for C₄H₆ (1-Methylcyclopropene)

using model chemistry: MP2=FULL/6-31+G**

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 (1-Methylcyclopropene)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

All results from a given calculation for C₄H₆ (1-Methylcyclopropene)