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	hartrees
Energy at 0K	-263.589225
Energy at 298.15K	-263.593096
HF Energy	-262.700249
Nuclear repulsion energy	178.834826

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3166	2949	0.00
2	A_g	2446	2279	0.00
3	A_g	1530	1425	0.00
4	A_g	1447	1348	0.00
5	A_g	1076	1003	0.00
6	A_g	994	926	0.00
7	A_g	517	482	0.00
8	A_g	221	206	0.00
9	A_u	3232	3011	0.74
10	A_u	1240	1155	0.12
11	A_u	787	733	1.38
12	A_u	385	359	0.05
13	A_u	78	72	22.11
14	B_g	3214	2995	0.00
15	B_g	1353	1260	0.00
16	B_g	1071	998	0.00
17	B_g	349	325	0.00
18	B_u	3173	2956	3.10
19	B_u	2447	2279	4.25
20	B_u	1536	1431	12.59
21	B_u	1334	1243	2.26
22	B_u	958	892	8.48
23	B_u	519	484	1.37
24	B_u	130	121	23.11

Atom	x (Å)	y (Å)	z (Å)
C1	0.426	0.640	0.000
C2	-0.426	-0.640	0.000
C3	-0.426	1.837	0.000
C4	0.426	-1.837	0.000
N5	1.121	-2.764	0.000
N6	-1.121	2.764	0.000
H7	1.066	0.668	0.879
H8	1.066	0.668	-0.879
H9	-1.066	-0.668	0.879
H10	-1.066	-0.668	-0.879

	C1	C2	C3	C4	N5	N6	H7	H8	H9	H10
C1		1.5378	1.4695	2.4771	3.4740	2.6276	1.0876	1.0876	2.1705	2.1705
C2	1.5378		2.4771	1.4695	2.6276	3.4740	2.1705	2.1705	1.0876	1.0876
C3	1.4695	2.4771		3.7718	4.8541	1.1583	2.0896	2.0896	2.7310	2.7310
C4	2.4771	1.4695	3.7718		1.1583	4.8541	2.7310	2.7310	2.0896	2.0896
N5	3.4740	2.6276	4.8541	1.1583		5.9650	3.5430	3.5430	3.1542	3.1542
N6	2.6276	3.4740	1.1583	4.8541	5.9650		3.1542	3.1542	3.5430	3.5430
H7	1.0876	2.1705	2.0896	2.7310	3.5430	3.1542		1.7575	2.5168	3.0697
H8	1.0876	2.1705	2.0896	2.7310	3.5430	3.1542	1.7575		3.0697	2.5168
H9	2.1705	1.0876	2.7310	2.0896	3.1542	3.5430	2.5168	3.0697		1.7575
H10	2.1705	1.0876	2.7310	2.0896	3.1542	3.5430	3.0697	2.5168	1.7575

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	110.891	C1	C2	H9	110.352
C1	C2	H10	110.352	C1	C3	N6	178.581
C2	C1	C3	110.891	C2	C1	H7	110.352
C2	C1	H8	110.352	C2	C4	N5	178.581
C3	C1	H7	108.683	C3	C1	H8	108.683
C4	C2	H9	108.683	C4	C2	H10	108.683
H7	C1	H8	107.797	H9	C2	H10	107.797

All results from a given calculation for C₄H₄N₂ (Succinonitrile)

using model chemistry: MP3=FULL/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 C4H4N2 (Succinonitrile)

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

States and conformations

All results from a given calculation for C₄H₄N₂ (Succinonitrile)