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	hartrees
Energy at 0K	-270.632023
Energy at 298.15K	-270.641400
Nuclear repulsion energy	288.092261

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3309	3113	6.75
2	A₁	3199	3009	6.86
3	A₁	3133	2947	38.31
4	A₁	1629	1532	0.31
5	A₁	1533	1442	1.27
6	A₁	1277	1201	4.90
7	A₁	1144	1076	0.51
8	A₁	971	913	2.37
9	A₁	912	858	7.65
10	A₁	798	750	1.28
11	A₁	742	698	73.02
12	A₁	428	402	8.23
13	A₂	3282	3087	0.00
14	A₂	1324	1246	0.00
15	A₂	1293	1216	0.00
16	A₂	1151	1083	0.00
17	A₂	951	894	0.00
18	A₂	900	846	0.00
19	A₂	722	680	0.00
20	A₂	453	426	0.00
21	B₁	3307	3111	16.87
22	B₁	3208	3017	29.47
23	B₁	1589	1495	10.66
24	B₁	1259	1184	2.55
25	B₁	1100	1035	0.85
26	B₁	1055	992	0.27
27	B₁	944	888	1.42
28	B₁	675	635	44.75
29	B₁	513	482	9.57
30	B₂	3284	3089	8.68
31	B₂	3197	3007	51.15
32	B₂	1369	1288	23.14
33	B₂	1299	1222	0.02
34	B₂	1188	1118	0.83
35	B₂	983	924	0.00
36	B₂	919	864	0.09
37	B₂	898	844	4.58
38	B₂	827	778	6.68
39	B₂	554	521	1.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.347
C2	0.000	1.121	0.272
C3	0.000	-1.121	0.272
C4	1.236	0.674	-0.517
C5	1.236	-0.674	-0.517
C6	-1.236	0.674	-0.517
C7	-1.236	-0.674	-0.517
H8	-0.899	0.000	1.965
H9	0.899	0.000	1.965
H10	0.000	2.154	0.614
H11	0.000	-2.154	0.614
H12	1.923	1.339	-1.021
H13	1.923	-1.339	-1.021
H14	-1.923	1.339	-1.021
H15	-1.923	-1.339	-1.021

	C1	C2	C3	C4	C5	C6	C7	H8	H9	H10	H11	H12	H13	H14	H15
C1		1.5533	1.5533	2.3361	2.3361	2.3361	2.3361	1.0911	1.0911	2.2754	2.2754	3.3315	3.3315	3.3315	3.3315
C2	1.5533		2.2419	1.5329	2.3179	1.5329	2.3179	2.2208	2.2208	1.0883	3.2928	2.3274	3.3796	2.3274	3.3796
C3	1.5533	2.2419		2.3179	1.5329	2.3179	1.5329	2.2208	2.2208	3.2928	1.0883	3.3796	2.3274	3.3796	2.3274
C4	2.3361	1.5329	2.3179		1.3483	2.4723	2.8161	3.3428	2.5937	2.2354	3.2872	1.0808	2.1863	3.2676	3.7801
C5	2.3361	2.3179	1.5329	1.3483		2.8161	2.4723	3.3428	2.5937	3.2872	2.2354	2.1863	1.0808	3.7801	3.2676
C6	2.3361	1.5329	2.3179	2.4723	2.8161		1.3483	2.5937	3.3428	2.2354	3.2872	3.2676	3.7801	1.0808	2.1863
C7	2.3361	2.3179	1.5329	2.8161	2.4723	1.3483		2.5937	3.3428	3.2872	2.2354	3.7801	3.2676	2.1863	1.0808
H8	1.0911	2.2208	2.2208	3.3428	3.3428	2.5937	2.5937		1.7988	2.6970	2.6970	4.3213	4.3213	3.4286	3.4286
H9	1.0911	2.2208	2.2208	2.5937	2.5937	3.3428	3.3428	1.7988		2.6970	2.6970	3.4286	3.4286	4.3213	4.3213
H10	2.2754	1.0883	3.2928	2.2354	3.2872	2.2354	3.2872	2.6970	2.6970		4.3081	2.6522	4.3097	2.6522	4.3097
H11	2.2754	3.2928	1.0883	3.2872	2.2354	3.2872	2.2354	2.6970	2.6970	4.3081		4.3097	2.6522	4.3097	2.6522
H12	3.3315	2.3274	3.3796	1.0808	2.1863	3.2676	3.7801	4.3213	3.4286	2.6522	4.3097		2.6786	3.8463	4.6871
H13	3.3315	3.3796	2.3274	2.1863	1.0808	3.7801	3.2676	4.3213	3.4286	4.3097	2.6522	2.6786		4.6871	3.8463
H14	3.3315	2.3274	3.3796	3.2676	3.7801	1.0808	2.1863	3.4286	4.3213	2.6522	4.3097	3.8463	4.6871		2.6786
H15	3.3315	3.3796	2.3274	3.7801	3.2676	2.1863	1.0808	3.4286	4.3213	4.3097	2.6522	4.6871	3.8463	2.6786

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	98.388	C1	C2	C6	98.388
C1	C2	H10	117.870	C1	C3	C5	98.388
C1	C3	C7	98.388	C1	C3	H11	117.870
C2	C1	C3	92.379	C2	C1	H8	113.074
C2	C1	H9	113.074	C2	C4	C5	106.945
C2	C4	H12	124.963	C2	C6	C7	106.945
C2	C6	H14	124.963	C3	C1	H8	113.074
C3	C1	H9	113.074	C3	C5	C4	106.945
C3	C5	H13	124.963	C3	C7	C6	106.945
C3	C7	H15	124.963	C4	C2	C6	107.494
C4	C2	H10	116.003	C4	C5	H13	127.982
C5	C3	C7	107.494	C5	C3	H11	116.003
C5	C4	H12	127.982	C6	C2	H10	116.003
C6	C7	H15	127.982	C7	C3	H11	116.003
C7	C6	H14	127.982	H8	C1	H9	111.037

All results from a given calculation for C₇H₈ (Norbornadiene)

using model chemistry: MP2/6-31+G**

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: MP2/6-31+G**

States and conformations

All results from a given calculation for C₇H₈ (Norbornadiene)