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	hartrees
Energy at 0K	-270.707179
Energy at 298.15K	-270.716536
Nuclear repulsion energy	287.751634

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3265	3102	6.60
2	A₁	3161	3004	7.02
3	A₁	3091	2937	37.69
4	A₁	1610	1530	0.14
5	A₁	1513	1438	1.51
6	A₁	1262	1199	4.97
7	A₁	1126	1070	0.28
8	A₁	962	915	2.02
9	A₁	910	865	6.37
10	A₁	790	751	1.70
11	A₁	739	702	58.16
12	A₁	427	406	5.64
13	A₂	3237	3076	0.00
14	A₂	1305	1240	0.00
15	A₂	1269	1206	0.00
16	A₂	1147	1090	0.00
17	A₂	941	894	0.00
18	A₂	890	846	0.00
19	A₂	718	682	0.00
20	A₂	451	429	0.00
21	B₁	3263	3101	16.13
22	B₁	3167	3009	30.41
23	B₁	1571	1493	4.62
24	B₁	1240	1178	2.33
25	B₁	1080	1027	0.48
26	B₁	1040	988	0.13
27	B₁	936	890	1.61
28	B₁	668	635	36.83
29	B₁	511	486	7.08
30	B₂	3239	3077	7.67
31	B₂	3159	3001	49.94
32	B₂	1348	1281	22.06
33	B₂	1279	1215	0.09
34	B₂	1174	1115	0.52
35	B₂	980	931	0.00
36	B₂	912	867	0.03
37	B₂	889	845	4.54
38	B₂	822	781	6.39
39	B₂	549	522	1.26

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.350
C2	0.000	1.122	0.274
C3	0.000	-1.122	0.274
C4	1.237	0.673	-0.519
C5	1.237	-0.673	-0.519
C6	-1.237	0.673	-0.519
C7	-1.237	-0.673	-0.519
H8	-0.905	0.000	1.965
H9	0.905	0.000	1.965
H10	0.000	2.157	0.619
H11	0.000	-2.157	0.619
H12	1.925	1.341	-1.025
H13	1.925	-1.341	-1.025
H14	-1.925	1.341	-1.025
H15	-1.925	-1.341	-1.025

	C1	C2	C3	C4	C5	C6	C7	H8	H9	H10	H11	H12	H13	H14	H15
C1		1.5542	1.5542	2.3398	2.3398	2.3398	2.3398	1.0945	1.0945	2.2775	2.2775	3.3381	3.3381	3.3381	3.3381
C2	1.5542		2.2435	1.5362	2.3198	1.5362	2.3198	2.2223	2.2223	1.0912	3.2969	2.3325	3.3847	2.3325	3.3847
C3	1.5542	2.2435		2.3198	1.5362	2.3198	1.5362	2.2223	2.2223	3.2969	1.0912	3.3847	2.3325	3.3847	2.3325
C4	2.3398	1.5362	2.3198		1.3467	2.4743	2.8170	3.3486	2.5953	2.2418	3.2918	1.0839	2.1877	3.2710	3.7830
C5	2.3398	2.3198	1.5362	1.3467		2.8170	2.4743	3.3486	2.5953	3.2918	2.2418	2.1877	1.0839	3.7830	3.2710
C6	2.3398	1.5362	2.3198	2.4743	2.8170		1.3467	2.5953	3.3486	2.2418	3.2918	3.2710	3.7830	1.0839	2.1877
C7	2.3398	2.3198	1.5362	2.8170	2.4743	1.3467		2.5953	3.3486	3.2918	2.2418	3.7830	3.2710	2.1877	1.0839
H8	1.0945	2.2223	2.2223	3.3486	3.3486	2.5953	2.5953		1.8097	2.6991	2.6991	4.3300	4.3300	3.4326	3.4326
H9	1.0945	2.2223	2.2223	2.5953	2.5953	3.3486	3.3486	1.8097		2.6991	2.6991	3.4326	3.4326	4.3300	4.3300
H10	2.2775	1.0912	3.2969	2.2418	3.2918	2.2418	3.2918	2.6991	2.6991		4.3141	2.6597	4.3176	2.6597	4.3176
H11	2.2775	3.2969	1.0912	3.2918	2.2418	3.2918	2.2418	2.6991	2.6991	4.3141		4.3176	2.6597	4.3176	2.6597
H12	3.3381	2.3325	3.3847	1.0839	2.1877	3.2710	3.7830	4.3300	3.4326	2.6597	4.3176		2.6814	3.8496	4.6914
H13	3.3381	3.3847	2.3325	2.1877	1.0839	3.7830	3.2710	4.3300	3.4326	4.3176	2.6597	2.6814		4.6914	3.8496
H14	3.3381	2.3325	3.3847	3.2710	3.7830	1.0839	2.1877	3.4326	4.3300	2.6597	4.3176	3.8496	4.6914		2.6814
H15	3.3381	3.3847	2.3325	3.7830	3.2710	2.1877	1.0839	3.4326	4.3300	4.3176	2.6597	4.6914	3.8496	2.6814

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	98.422	C1	C2	C6	98.422
C1	C2	H10	117.772	C1	C3	C5	98.422
C1	C3	C7	98.422	C1	C3	H11	117.772
C2	C1	C3	92.397	C2	C1	H8	112.920
C2	C1	H9	112.920	C2	C4	C5	106.971
C2	C4	H12	124.916	C2	C6	C7	106.971
C2	C6	H14	124.916	C3	C1	H8	112.920
C3	C1	H9	112.920	C3	C5	C4	106.971
C3	C5	H13	124.916	C3	C7	C6	106.971
C3	C7	H15	124.916	C4	C2	C6	107.285
C4	C2	H10	116.105	C4	C5	H13	128.002
C5	C3	C7	107.285	C5	C3	H11	116.105
C5	C4	H12	128.002	C6	C2	H10	116.105
C6	C7	H15	128.002	C7	C3	H11	116.105
C7	C6	H14	128.002	H8	C1	H9	111.521

All results from a given calculation for C₇H₈ (Norbornadiene)

using model chemistry: MP2/6-311G**

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 C7H8 (Norbornadiene)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for C₇H₈ (Norbornadiene)