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	hartrees
Energy at 0K	-264.231996
Energy at 298.15K	-264.235719
Nuclear repulsion energy	176.866593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	2984	2968	0.00
2	A_g	2256	2244	0.00
3	A_g	1438	1430	0.00
4	A_g	1336	1329	0.00
5	A_g	972	967	0.00
6	A_g	934	929	0.00
7	A_g	490	487	0.00
8	A_g	214	212	0.00
9	A_u	3037	3021	1.17
10	A_u	1177	1171	0.00
11	A_u	752	748	2.46
12	A_u	384	382	0.00
13	A_u	77	77	21.79
14	B_g	3019	3003	0.00
15	B_g	1278	1271	0.00
16	B_g	1006	1000	0.00
17	B_g	347	345	0.00
18	B_u	2993	2977	4.30
19	B_u	2257	2246	9.72
20	B_u	1444	1436	13.84
21	B_u	1258	1251	3.24
22	B_u	901	897	3.36
23	B_u	503	500	2.95
24	B_u	127	127	22.24

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.783	0.000
C2	0.000	-0.783	0.000
C3	-1.369	1.324	0.000
C4	1.369	-1.324	0.000
N5	2.466	-1.741	0.000
N6	-2.466	1.741	0.000
H7	0.535	1.160	0.887
H8	0.535	1.160	-0.887
H9	-0.535	-1.160	0.887
H10	-0.535	-1.160	-0.887

	C1	C2	C3	C4	N5	N6	H7	H8	H9	H10
C1		1.5658	1.4722	2.5125	3.5287	2.6458	1.1024	1.1024	2.2019	2.2019
C2	1.5658		2.5125	1.4722	2.6458	3.5287	2.2019	2.2019	1.1024	1.1024
C3	1.4722	2.5125		3.8089	4.9094	1.1737	2.1068	2.1068	2.7664	2.7664
C4	2.5125	1.4722	3.8089		1.1737	4.9094	2.7664	2.7664	2.1068	2.1068
N5	3.5287	2.6458	4.9094	1.1737		6.0375	3.5963	3.5963	3.1828	3.1828
N6	2.6458	3.5287	1.1737	4.9094	6.0375		3.1828	3.1828	3.5963	3.5963
H7	1.1024	2.2019	2.1068	2.7664	3.5963	3.1828		1.7745	2.5547	3.1105
H8	1.1024	2.2019	2.1068	2.7664	3.5963	3.1828	1.7745		3.1105	2.5547
H9	2.2019	1.1024	2.7664	2.1068	3.1828	3.5963	2.5547	3.1105		1.7745
H10	2.2019	1.1024	2.7664	2.1068	3.1828	3.5963	3.1105	2.5547	1.7745

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	111.548	C1	C2	H9	110.008
C1	C2	H10	110.008	C1	C3	N6	179.266
C2	C1	C3	111.548	C2	C1	H7	110.008
C2	C1	H8	110.008	C2	C4	N5	179.266
C3	C1	H7	108.989	C3	C1	H8	108.989
C4	C2	H9	108.989	C4	C2	H10	108.989
H7	C1	H8	107.190	H9	C2	H10	107.190

All results from a given calculation for C₄H₄N₂ (Succinonitrile)

using model chemistry: BLYP/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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Number	Element	Mulliken
1	C	-0.142
2	C	-0.142
3	C	0.238
4	C	0.238
5	N	-0.501
6	N	-0.501
7	H	0.203
8	H	0.203
9	H	0.203
10	H	0.203

<r²>	215.140
(<r²>)^1/2	14.668

All results from a given calculation for C4H4N2 (Succinonitrile)

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

States and conformations

All results from a given calculation for C₄H₄N₂ (Succinonitrile)