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	hartrees
Energy at 0K	-192.887558
Energy at 298.15K	-192.894564
HF Energy	-192.696315
Nuclear repulsion energy	124.255397

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3753	3560	15.99
2	A	3282	3113	14.05
3	A	3266	3098	3.57
4	A	3191	3027	6.69
5	A	3181	3017	13.49
6	A	3153	2991	40.56
7	A	1551	1471	12.17
8	A	1498	1421	1.40
9	A	1453	1378	9.16
10	A	1329	1260	82.87
11	A	1256	1192	50.15
12	A	1223	1160	0.16
13	A	1214	1151	8.26
14	A	1154	1095	0.59
15	A	1094	1038	3.61
16	A	1079	1023	19.76
17	A	1009	957	10.90
18	A	952	903	23.41
19	A	855	811	9.44
20	A	835	792	5.54
21	A	774	734	3.41
22	A	413	392	24.10
23	A	408	387	10.39
24	A	333	316	110.91

Atom	x (Å)	y (Å)	z (Å)
C1	-0.237	-0.014	0.482
C2	0.909	-0.742	-0.136
C3	0.886	0.773	-0.137
O4	-1.461	-0.112	-0.198
H5	-0.313	-0.018	1.569
H6	1.610	-1.255	0.512
H7	0.705	-1.239	-1.077
H8	1.571	1.308	0.512
H9	0.677	1.260	-1.083
H10	-1.914	0.739	-0.101

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4918	1.5045	1.4037	1.0894	2.2260	2.1953	2.2398	2.2153	1.9287
C2	1.4918		1.5144	2.4526	2.2189	1.0842	1.0837	2.2489	2.2262	3.1883
C3	1.5045	1.5144		2.5090	2.2307	2.2488	2.2276	1.0848	1.0844	2.8012
O4	1.4037	2.4526	2.5090		2.1092	3.3530	2.5944	3.4225	2.6899	0.9695
H5	1.0894	2.2189	2.2307	2.1092		2.5192	3.0865	2.5354	3.1063	2.4340
H6	2.2260	1.0842	2.2488	3.3530	2.5192		1.8289	2.5629	3.1208	4.0958
H7	2.1953	1.0837	2.2276	2.5944	3.0865	1.8289		3.1241	2.4987	3.4244
H8	2.2398	2.2489	1.0848	3.4225	2.5354	2.5629	3.1241		1.8293	3.5846
H9	2.2153	2.2262	1.0844	2.6899	3.1063	3.1208	2.4987	1.8293		2.8202
H10	1.9287	3.1883	2.8012	0.9695	2.4340	4.0958	3.4244	3.5846	2.8202

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.059	C1	C2	H6	118.712
C1	C2	H7	116.046	C1	C3	C2	59.225
C1	C3	H8	118.872	C1	C3	H9	116.737
C1	O4	H10	107.299	C2	C1	C3	60.715
C2	C1	O4	115.753	C2	C1	H5	117.707
C2	C3	H8	118.893	C2	C3	H9	116.913
C3	C1	O4	119.207	C3	C1	H5	117.735
C3	C2	H6	118.923	C3	C2	H7	117.087
O4	C1	H5	114.978	H6	C2	H7	115.055
H8	C3	H9	114.980

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: B2PLYP=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: B2PLYP=FULL/6-31G*

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)