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	hartrees
Energy at 0K	-688.390367
Energy at 298.15K	-688.394164
HF Energy	-687.519212
Nuclear repulsion energy	265.396540

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3355	3148	0.09
2	A'	3336	3130	0.50
3	A'	3318	3113	1.59
4	A'	1680	1576	16.72
5	A'	1585	1487	58.53
6	A'	1459	1369	13.65
7	A'	1307	1226	53.11
8	A'	1260	1182	28.75
9	A'	1187	1114	8.26
10	A'	1133	1063	16.21
11	A'	1062	997	21.05
12	A'	960	900	32.48
13	A'	913	857	1.62
14	A'	509	478	3.37
15	A'	322	303	0.45
16	A"	821	770	5.29
17	A"	787	738	24.66
18	A"	744	698	45.08
19	A"	630	592	12.56
20	A"	586	550	1.36
21	A"	229	215	1.92

Atom	x (Å)	y (Å)
C1	0.000	0.267
C2	1.306	-0.094
C3	1.300	-1.531
C4	-0.002	-1.907
O5	-0.821	-0.810
Cl6	-0.757	1.797
H7	2.156	0.571
H8	2.159	-2.186
H9	-0.507	-2.860

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3548	2.2184	2.1739	1.3540	1.7069	2.1776	3.2675	3.1675
C2	1.3548		1.4375	2.2361	2.2442	2.7979	1.0793	2.2595	3.3074
C3	2.2184	1.4375		1.3552	2.2397	3.9119	2.2700	1.0802	2.2428
C4	2.1739	2.2361	1.3552		1.3687	3.7799	3.2864	2.1788	1.0782
O5	1.3540	2.2442	2.2397	1.3687		2.6077	3.2818	3.2818	2.0736
Cl6	1.7069	2.7979	3.9119	3.7799	2.6077		3.1603	4.9358	4.6633
H7	2.1776	1.0793	2.2700	3.2864	3.2818	3.1603		2.7572	4.3433
H8	3.2675	2.2595	1.0802	2.1788	3.2818	4.9358	2.7572		2.7495
H9	3.1675	3.3074	2.2428	1.0782	2.0736	4.6633	4.3433	2.7495

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	105.177	C1	C2	H7	126.554
C1	O5	C4	105.959	C2	C1	O5	111.884
C2	C1	Cl6	131.741	C2	C3	C4	106.359
C2	C3	H8	127.081	C3	C2	H7	128.269
C3	C4	O5	110.620	C3	C4	H9	134.025
C4	C3	H8	126.561	O5	C1	Cl6	116.374
O5	C4	H9	115.355

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

using model chemistry: MP3=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 C4H3ClO (Furan, 2-chloro)

using model chemistry: MP3=FULL/6-31G*

States and conformations

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