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	hartrees
Energy at 0K	-192.525719
Energy at 298.15K	-192.532773
HF Energy	-191.905820
Nuclear repulsion energy	124.222163

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3751	3563	16.68
2	A	3273	3108	13.30
3	A	3257	3094	3.42
4	A	3185	3025	5.64
5	A	3174	3014	13.06
6	A	3155	2996	34.84
7	A	1566	1488	13.43
8	A	1502	1427	1.92
9	A	1465	1391	6.13
10	A	1346	1279	96.68
11	A	1274	1210	36.11
12	A	1231	1169	0.75
13	A	1225	1163	6.68
14	A	1169	1110	0.80
15	A	1113	1057	4.86
16	A	1103	1048	17.04
17	A	1023	971	8.99
18	A	973	924	24.89
19	A	867	823	9.23
20	A	847	805	6.42
21	A	785	746	3.31
22	A	420	399	25.52
23	A	414	393	9.13
24	A	339	322	115.71

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	-0.015	0.485
C2	0.910	-0.740	-0.137
C3	0.883	0.773	-0.138
O4	-1.459	-0.114	-0.198
H5	-0.313	-0.021	1.574
H6	1.618	-1.253	0.508
H7	0.700	-1.240	-1.079
H8	1.571	1.311	0.510
H9	0.666	1.263	-1.084
H10	-1.913	0.740	-0.102

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4909	1.5025	1.4061	1.0916	2.2283	2.1953	2.2404	2.2148	1.9319
C2	1.4909		1.5133	2.4514	2.2229	1.0869	1.0863	2.2502	2.2284	3.1877
C3	1.5025	1.5133		2.5051	2.2340	2.2501	2.2294	1.0875	1.0871	2.7962
O4	1.4061	2.4514	2.5051		2.1125	3.3568	2.5897	3.4227	2.6826	0.9719
H5	1.0916	2.2229	2.2340	2.1125		2.5265	3.0901	2.5411	3.1098	2.4386
H6	2.2283	1.0869	2.2501	3.3568	2.5265		1.8334	2.5646	3.1255	4.1005
H7	2.1953	1.0863	2.2294	2.5897	3.0901	1.8334		3.1289	2.5025	3.4211
H8	2.2404	2.2502	1.0875	3.4227	2.5411	2.5646	3.1289		1.8334	3.5830
H9	2.2148	2.2284	1.0871	2.6826	3.1098	3.1255	2.5025	1.8334		2.8087
H10	1.9319	3.1877	2.7962	0.9719	2.4386	4.1005	3.4211	3.5830	2.8087

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.010	C1	C2	H6	118.794
C1	C2	H7	115.934	C1	C3	C2	59.255
C1	C3	H8	118.899	C1	C3	H9	116.668
C1	O4	H10	107.257	C2	C1	C3	60.735
C2	C1	O4	115.569	C2	C1	H5	117.976
C2	C3	H8	118.899	C2	C3	H9	117.000
C3	C1	O4	118.889	C3	C1	H5	118.036
C3	C2	H6	118.929	C3	C2	H7	117.148
O4	C1	H5	114.933	H6	C2	H7	115.049
H8	C3	H9	114.937

All results from a given calculation for C₃H₅OH (Cyclopropanol)

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

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: CCSD=FULL/6-31G*

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)