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	hartrees
Energy at 0K	-689.519378
Energy at 298.15K	-689.523216
HF Energy	-689.519378
Nuclear repulsion energy	265.718960

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3343	3171	0.09
2	A'	3319	3148	0.29
3	A'	3298	3128	2.22
4	A'	1654	1569	21.52
5	A'	1560	1479	58.56
6	A'	1443	1368	16.43
7	A'	1282	1216	33.56
8	A'	1246	1182	29.49
9	A'	1181	1120	9.33
10	A'	1119	1061	13.01
11	A'	1041	987	24.08
12	A'	952	903	32.16
13	A'	905	858	1.27
14	A'	503	477	5.06
15	A'	318	301	0.40
16	A"	897	850	0.04
17	A"	831	788	26.04
18	A"	751	712	48.35
19	A"	643	610	5.19
20	A"	619	587	6.30
21	A"	229	217	1.56

Atom	x (Å)	y (Å)
C1	0.000	0.263
C2	1.308	-0.095
C3	1.301	-1.528
C4	-0.002	-1.903
O5	-0.813	-0.810
Cl6	-0.761	1.795
H7	2.157	0.571
H8	2.159	-2.184
H9	-0.508	-2.855

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3558	2.2138	2.1660	1.3465	1.7109	2.1787	3.2635	3.1591
C2	1.3558		1.4335	2.2324	2.2379	2.8024	1.0792	2.2562	3.3036
C3	2.2138	1.4335		1.3553	2.2320	3.9113	2.2674	1.0801	2.2428
C4	2.1660	2.2324	1.3553		1.3605	3.7754	3.2834	2.1788	1.0781
O5	1.3465	2.2379	2.2320	1.3605		2.6062	3.2752	3.2738	2.0671
Cl6	1.7109	2.8024	3.9113	3.7754	2.6062		3.1645	4.9361	4.6571
H7	2.1787	1.0792	2.2674	3.2834	3.2752	3.1645		2.7556	4.3403
H8	3.2635	2.2562	1.0801	2.1788	3.2738	4.9361	2.7556		2.7495
H9	3.1591	3.3036	2.2428	1.0781	2.0671	4.6571	4.3403	2.7495

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	105.029	C1	C2	H7	126.578
C1	O5	C4	106.285	C2	C1	O5	111.818
C2	C1	Cl6	131.736	C2	C3	C4	106.324
C2	C3	H8	127.120	C3	C2	H7	128.393
C3	C4	O5	110.543	C3	C4	H9	134.033
C4	C3	H8	126.556	O5	C1	Cl6	116.445
O5	C4	H9	115.424

All results from a given calculation for C₄H₃ClO (Furan, 2-chloro)

using model chemistry: wB97X-D/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 C4H3ClO (Furan, 2-chloro)

using model chemistry: wB97X-D/6-31G*

States and conformations

All results from a given calculation for C₄H₃ClO (Furan, 2-chloro)