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	hartrees
Energy at 0K	-684.695156
Energy at 298.15K	-684.699101
HF Energy	-684.163881
Nuclear repulsion energy	263.255230

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3409	3172	0.06
2	A'	3382	3147	0.99
3	A'	3361	3128	1.30
4	A'	1668	1552	24.53
5	A'	1566	1457	49.42
6	A'	1445	1344	13.60
7	A'	1322	1230	10.42
8	A'	1230	1145	30.37
9	A'	1178	1097	28.29
10	A'	1092	1016	18.88
11	A'	1055	981	7.60
12	A'	959	892	19.27
13	A'	945	879	21.51
14	A'	507	472	3.51
15	A'	316	294	0.44
16	A"	929	864	0.34
17	A"	890	828	21.04
18	A"	805	749	75.37
19	A"	670	623	4.62
20	A"	630	586	10.56
21	A"	241	224	3.56

Atom	x (Å)	y (Å)
C1	0.000	0.282
C2	1.295	-0.104
C3	1.283	-1.558
C4	-0.013	-1.944
O5	-0.847	-0.815
Cl6	-0.729	1.825
H7	2.152	0.540
H8	2.143	-2.200
H9	-0.513	-2.891

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3510	2.2427	2.2259	1.3862	1.7063	2.1676	3.2787	3.2136
C2	1.3510		1.4540	2.2578	2.2571	2.7954	1.0723	2.2610	3.3218
C3	2.2427	1.4540		1.3526	2.2559	3.9355	2.2709	1.0732	2.2365
C4	2.2259	2.2578	1.3526		1.4034	3.8361	3.2956	2.1713	1.0703
O5	1.3862	2.2571	2.2559	1.4034		2.6426	3.2915	3.2951	2.1020
Cl6	1.7063	2.7954	3.9355	3.8361	2.6426		3.1543	4.9440	4.7202
H7	2.1676	1.0723	2.2709	3.2956	3.2915	3.1543		2.7400	4.3443
H8	3.2787	2.2610	1.0732	2.1713	3.2951	4.9440	2.7400		2.7443
H9	3.2136	3.3218	2.2365	1.0703	2.1020	4.7202	4.3443	2.7443

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	106.118	C1	C2	H7	126.501
C1	O5	C4	105.866	C2	C1	O5	111.092
C2	C1	Cl6	131.871	C2	C3	C4	107.063
C2	C3	H8	126.279	C3	C2	H7	127.381
C3	C4	O5	109.861	C3	C4	H9	134.427
C4	C3	H8	126.658	O5	C1	Cl6	117.036
O5	C4	H9	115.712

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

using model chemistry: CID/3-21G*

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: CID/3-21G*

States and conformations

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