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	hartrees
Energy at 0K	-1149.667868
Energy at 298.15K	-1149.671830
HF Energy	-1148.499635
Nuclear repulsion energy	447.271212

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3218	3094
2	A_g	1640	1577
3	A_g	1216	1169
4	A_g	1125	1082
5	A_g	761	732
6	A_g	330	318
7	A_u	893	859
8	A_u	407	391
9	B_1g	808	777
10	B_1u	3203	3080
11	B_1u	1524	1466
12	B_1u	1128	1085
13	B_1u	1023	984
14	B_1u	555	533
15	B_2g	864	830
16	B_2g	538	517
17	B_2g	292	281
18	B_2u	3216	3093
19	B_2u	1437	1381
20	B_2u	1355	1303
21	B_2u	1138	1094
22	B_2u	222	213
23	B_3g	3204	3081
24	B_3g	1627	1564
25	B_3g	1322	1271
26	B_3g	637	612
27	B_3g	355	342
28	B_3u	789	758
29	B_3u	475	457
30	B_3u	103	99

Atom	y (Å)	z (Å)
C1	0.000	1.389
C2	0.000	-1.389
C3	1.216	0.699
C4	-1.216	0.699
C5	-1.216	-0.699
C6	1.216	-0.699
Cl7	0.000	3.136
Cl8	0.000	-3.136
H9	2.156	1.249
H10	-2.156	1.249
H11	-2.156	-1.249
H12	2.156	-1.249

	C1	C2	C3	C4	C5	C6	Cl7	Cl8	H9	H10	H11	H12
C1		2.7790	1.3984	1.3984	2.4168	2.4168	1.7466	4.5256	2.1606	2.1606	3.4077	3.4077
C2	2.7790		2.4168	2.4168	1.3984	1.3984	4.5256	1.7466	3.4077	3.4077	2.1606	2.1606
C3	1.3984	2.4168		2.4323	2.8055	1.3982	2.7236	4.0234	1.0892	3.4168	3.8947	2.1634
C4	1.3984	2.4168	2.4323		1.3982	2.8055	2.7236	4.0234	3.4168	1.0892	2.1634	3.8947
C5	2.4168	1.3984	2.8055	1.3982		2.4323	4.0234	2.7236	3.8947	2.1634	1.0892	3.4168
C6	2.4168	1.3984	1.3982	2.8055	2.4323		4.0234	2.7236	2.1634	3.8947	3.4168	1.0892
Cl7	1.7466	4.5256	2.7236	2.7236	4.0234	4.0234		6.2722	2.8650	2.8650	4.8869	4.8869
Cl8	4.5256	1.7466	4.0234	4.0234	2.7236	2.7236	6.2722		4.8869	4.8869	2.8650	2.8650
H9	2.1606	3.4077	1.0892	3.4168	3.8947	2.1634	2.8650	4.8869		4.3121	4.9839	2.4990
H10	2.1606	3.4077	3.4168	1.0892	2.1634	3.8947	2.8650	4.8869	4.3121		2.4990	4.9839
H11	3.4077	2.1606	3.8947	2.1634	1.0892	3.4168	4.8869	2.8650	4.9839	2.4990		4.3121
H12	3.4077	2.1606	2.1634	3.8947	3.4168	1.0892	4.8869	2.8650	2.4990	4.9839	4.3121

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C6	119.583	C1	C3	H9	120.066
C1	C4	C5	119.583	C1	C4	H10	120.066
C2	C5	C4	119.583	C2	C5	H11	120.066
C2	C6	C3	119.583	C2	C6	H12	120.066
C3	C1	C4	120.834	C3	C1	Cl7	119.583
C3	C6	H12	120.351	C4	C1	Cl7	119.583
C4	C5	H11	120.351	C5	C2	C6	120.834
C5	C2	Cl8	119.583	C5	C4	H10	120.351
C6	C2	Cl8	119.583	C6	C3	H9	120.351

All results from a given calculation for C₆H₄Cl₂ (1,4-dichlorobenzene)

using model chemistry: MP4=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 C6H4Cl2 (1,4-dichlorobenzene)

using model chemistry: MP4=FULL/6-31G*

States and conformations

All results from a given calculation for C₆H₄Cl₂ (1,4-dichlorobenzene)