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	hartrees
Energy at 0K	-192.670807
Energy at 298.15K	-192.677162
HF Energy	-191.973542
Nuclear repulsion energy	116.322952

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3864	3747
2	A	3236	3138
3	A	3161	3065
4	A	3140	3045
5	A	3098	3004
6	A	3010	2919
7	A	1678	1628
8	A	1518	1472
9	A	1464	1420
10	A	1434	1391
11	A	1369	1328
12	A	1298	1259
13	A	1235	1198
14	A	1160	1125
15	A	1076	1043
16	A	1008	977
17	A	952	923
18	A	921	893
19	A	910	882
20	A	654	634
21	A	452	438
22	A	369	358
23	A	335	325
24	A	112	108

Atom	x (Å)	y (Å)	z (Å)
C1	0.613	0.509	0.260
C2	-0.660	-0.291	0.374
C3	-1.801	0.030	-0.261
O4	1.689	-0.281	-0.248
H5	0.434	1.401	-0.364
H6	0.942	0.849	1.249
H7	-0.602	-1.193	0.987
H8	-2.700	-0.577	-0.169
H9	-1.867	0.921	-0.885
H10	1.370	-0.643	-1.079

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.5076	2.5158	1.4284	1.1028	1.0965	2.2141	3.5123	2.7620	1.9219
C2	1.5076		1.3453	2.4296	2.1458	2.1522	1.0916	2.1304	2.1242	2.5207
C3	2.5158	1.3453		3.5042	2.6245	3.2370	2.1188	1.0879	1.0901	3.3433
O4	1.4284	2.4296	3.5042		2.1014	2.0187	2.7579	4.3995	3.8072	0.9615
H5	1.1028	2.1458	2.6245	2.1014		1.7791	3.1026	3.7108	2.4074	2.3585
H6	1.0965	2.1522	3.2370	2.0187	1.7791		2.5738	4.1602	3.5284	2.7982
H7	2.2141	1.0916	2.1188	2.7579	3.1026	2.5738		2.4727	3.0938	2.9085
H8	3.5123	2.1304	1.0879	4.3995	3.7108	4.1602	2.4727		1.8575	4.1705
H9	2.7620	2.1242	1.0901	3.8072	2.4074	3.5284	3.0938	1.8575		3.5999
H10	1.9219	2.5207	3.3433	0.9615	2.3585	2.7982	2.9085	4.1705	3.5999

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.631	C1	C2	H7	115.899
C1	O4	H10	105.390	C2	C1	O4	111.663
C2	C1	H5	109.593	C2	C1	H6	110.474
C2	C3	H8	121.862	C2	C3	H9	121.083
C3	C2	H7	120.435	O4	C1	H5	111.590
O4	C1	H6	105.410	H5	C1	H6	107.981
H8	C3	H9	117.052

All results from a given calculation for C₃H₆O (2-Propen-1-ol)

using model chemistry: MP4/6-311G**

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 C3H6O (2-Propen-1-ol)

using model chemistry: MP4/6-311G**

States and conformations

All results from a given calculation for C₃H₆O (2-Propen-1-ol)