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	hartrees
Energy at 0K	-192.667468
Energy at 298.15K	-192.674501
HF Energy	-191.933526
Nuclear repulsion energy	125.011291

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3873	3641	34.38
2	A	3334	3134	3.53
3	A	3321	3121	1.30
4	A	3229	3035	2.62
5	A	3220	3026	5.78
6	A	3195	3003	25.22
7	A	1535	1443	16.67
8	A	1473	1385	1.98
9	A	1444	1357	6.12
10	A	1321	1242	72.80
11	A	1270	1194	49.47
12	A	1218	1145	7.72
13	A	1215	1142	0.25
14	A	1150	1081	0.78
15	A	1075	1011	2.86
16	A	1062	998	22.78
17	A	1021	959	7.78
18	A	965	907	22.18
19	A	860	809	9.87
20	A	839	789	4.53
21	A	773	727	2.25
22	A	413	388	23.81
23	A	405	381	5.31
24	A	337	317	98.84

Atom	x (Å)	y (Å)	z (Å)
C1	-0.237	-0.013	0.482
C2	0.903	-0.739	-0.137
C3	0.878	0.770	-0.138
O4	-1.449	-0.112	-0.196
H5	-0.304	-0.018	1.564
H6	1.604	-1.245	0.510
H7	0.691	-1.228	-1.075
H8	1.561	1.300	0.509
H9	0.660	1.248	-1.081
H10	-1.890	0.736	-0.105

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4860	1.4970	1.3927	1.0848	2.2146	2.1816	2.2264	2.1992	1.9072
C2	1.4860		1.5096	2.4352	2.2070	1.0789	1.0790	2.2377	2.2134	3.1585
C3	1.4970	1.5096		2.4901	2.2178	2.2373	2.2150	1.0795	1.0795	2.7684
O4	1.3927	2.4352	2.4901		2.1019	3.3318	2.5688	3.3993	2.6614	0.9601
H5	1.0848	2.2070	2.2178	2.1019		2.5017	3.0692	2.5162	3.0873	2.4222
H6	2.2146	1.0789	2.2373	3.3318	2.5017		1.8283	2.5449	3.1038	4.0625
H7	2.1816	1.0790	2.2150	2.5688	3.0692	1.8283		3.1074	2.4761	3.3851
H8	2.2264	2.2377	1.0795	3.3993	2.5162	2.5449	3.1074		1.8286	3.5501
H9	2.1992	2.2134	1.0795	2.6614	3.0873	3.1038	2.4761	1.8286		2.7779
H10	1.9072	3.1585	2.7684	0.9601	2.4222	4.0625	3.3851	3.5501	2.7779

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	59.959	C1	C2	H6	118.548
C1	C2	H7	115.631	C1	C3	C2	59.238
C1	C3	H8	118.669	C1	C3	H9	116.268
C1	O4	H10	106.868	C2	C1	C3	60.803
C2	C1	O4	115.504	C2	C1	H5	117.451
C2	C3	H8	118.656	C2	C3	H9	116.513
C3	C1	O4	118.975	C3	C1	H5	117.522
C3	C2	H6	118.671	C3	C2	H7	116.691
O4	C1	H5	115.520	H6	C2	H7	115.834
H8	C3	H9	115.763

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: MP2=FULL/6-31G(2df,p)

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 C3H5OH (Cyclopropanol)

using model chemistry: MP2=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)