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	hartrees
Energy at 0K	-190.315733
Energy at 298.15K
HF Energy	-190.247154
Nuclear repulsion energy	121.477275

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3776	3776	35.38
2	A	3593	3593	0.33
3	A	3587	3587	0.13
4	A	3441	3441	2.77
5	A	3431	3431	2.97
6	A	3397	3397	7.12
7	A	1670	1670	5.12
8	A	1611	1611	0.12
9	A	1592	1592	2.78
10	A	1460	1460	45.76
11	A	1318	1318	1.44
12	A	1308	1308	0.41
13	A	1268	1268	1.90
14	A	1247	1247	2.11
15	A	1231	1231	0.56
16	A	1216	1216	1.17
17	A	1082	1082	0.99
18	A	1033	1033	10.25
19	A	904	904	2.48
20	A	893	893	1.24
21	A	844	844	0.26
22	A	404	404	6.25
23	A	391	391	5.23
24	A	313	313	71.79

Atom	x (Å)	y (Å)	z (Å)
C1	-0.253	0.006	0.477
C2	0.934	-0.757	-0.110
C3	0.924	0.773	-0.155
O4	-1.509	-0.118	-0.224
H5	-0.316	0.042	1.581
H6	1.619	-1.261	0.578
H7	0.765	-1.284	-1.055
H8	1.601	1.323	0.506
H9	0.755	1.240	-1.131
H10	-1.982	0.747	0.044

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.5277	1.5401	1.4443	1.1067	2.2624	2.2464	2.2740	2.2635	1.9305
C2	1.5277		1.5303	2.5274	2.2495	1.0946	1.0949	2.2694	2.2497	3.2841
C3	1.5401	1.5303		2.5920	2.2557	2.2711	2.2503	1.0946	1.0947	2.9130
O4	1.4443	2.5274	2.5920		2.1698	3.4256	2.6872	3.5047	2.7919	1.0216
H5	1.1067	2.2495	2.2557	2.1698		2.5391	3.1425	2.5445	3.1527	2.3736
H6	2.2624	1.0946	2.2711	3.4256	2.5391		1.8433	2.5851	3.1501	4.1573
H7	2.2464	1.0949	2.2503	2.6872	3.1425	1.8433		3.1512	2.5251	3.5886
H8	2.2740	2.2694	1.0946	3.5047	2.5445	2.5851	3.1512		1.8440	3.6584
H9	2.2635	2.2497	1.0947	2.7919	3.1527	3.1501	2.5251	1.8440		3.0195
H10	1.9305	3.2841	2.9130	1.0216	2.3736	4.1573	3.5886	3.6584	3.0195

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.481	C1	C2	H6	118.317
C1	C2	H7	116.903	C1	C3	C2	59.676
C1	C3	H8	118.351	C1	C3	H9	117.430
C1	O4	H10	101.675	C2	C1	C3	59.844
C2	C1	O4	116.488	C2	C1	H5	116.372
C2	C3	H8	118.729	C2	C3	H9	117.000
C3	C1	O4	120.543	C3	C1	H5	115.951
C3	C2	H6	118.879	C3	C2	H7	117.044
O4	C1	H5	115.920	H6	C2	H7	114.681
H8	C3	H9	114.761

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: B2PLYP=FULLultrafine/STO-3G

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: B2PLYP=FULLultrafine/STO-3G

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)