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	hartrees
Energy at 0K	-189.564160
Energy at 298.15K	-189.574246
Nuclear repulsion energy	132.281225

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3416	3381	0.00
2	A_g	2927	2897	0.00
3	A_g	1591	1574	0.00
4	A_g	1402	1387	0.00
5	A_g	1331	1317	0.00
6	A_g	1126	1115	0.00
7	A_g	1055	1044	0.00
8	A_g	783	775	0.00
9	A_g	453	449	0.00
10	A_u	3498	3461	1.30
11	A_u	2988	2957	57.42
12	A_u	1338	1324	4.26
13	A_u	1033	1022	0.00
14	A_u	737	729	1.37
15	A_u	256	253	108.61
16	A_u	150	149	0.02
17	B_g	3499	3462	0.00
18	B_g	2960	2929	0.00
19	B_g	1313	1299	0.00
20	B_g	1252	1239	0.00
21	B_g	910	901	0.00
22	B_g	305	302	0.00
23	B_u	3415	3379	0.65
24	B_u	2939	2908	87.49
25	B_u	1590	1573	59.16
26	B_u	1421	1407	2.61
27	B_u	1263	1250	13.93
28	B_u	1116	1104	21.96
29	B_u	804	796	446.47
30	B_u	248	246	24.60

Atom	x (Å)	y (Å)	z (Å)
C1	0.391	0.651	0.000
C2	-0.391	-0.651	0.000
N3	-0.391	1.863	0.000
N4	0.391	-1.863	0.000
H5	1.002	-1.893	0.821
H6	1.002	-1.893	-0.821
H7	-1.002	1.893	0.821
H8	-1.002	1.893	-0.821
H9	-1.063	-0.662	-0.880
H10	-1.063	-0.662	0.880
H11	1.063	0.662	-0.880
H12	1.063	0.662	0.880

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5200	1.4424	2.5143	2.7425	2.7425	2.0389	2.0389	2.1482	2.1482	1.1072	1.1072
C2	1.5200		2.5143	1.4424	2.0389	2.0389	2.7425	2.7425	1.1072	1.1072	2.1482	2.1482
N3	1.4424	2.5143		3.8071	4.0893	4.0893	1.0238	1.0238	2.7568	2.7568	2.0815	2.0815
N4	2.5143	1.4424	3.8071		1.0238	1.0238	4.0893	4.0893	2.0815	2.0815	2.7568	2.7568
H5	2.7425	2.0389	4.0893	1.0238		1.6429	4.2835	4.5877	2.9453	2.4046	3.0703	2.5563
H6	2.7425	2.0389	4.0893	1.0238	1.6429		4.5877	4.2835	2.4046	2.9453	2.5563	3.0703
H7	2.0389	2.7425	1.0238	4.0893	4.2835	4.5877		1.6429	3.0703	2.5563	2.9453	2.4046
H8	2.0389	2.7425	1.0238	4.0893	4.5877	4.2835	1.6429		2.5563	3.0703	2.4046	2.9453
H9	2.1482	1.1072	2.7568	2.0815	2.9453	2.4046	3.0703	2.5563		1.7605	2.5043	3.0612
H10	2.1482	1.1072	2.7568	2.0815	2.4046	2.9453	2.5563	3.0703	1.7605		3.0612	2.5043
H11	1.1072	2.1482	2.0815	2.7568	3.0703	2.5563	2.9453	2.4046	2.5043	3.0612		1.7605
H12	1.1072	2.1482	2.0815	2.7568	2.5563	3.0703	2.4046	2.9453	3.0612	2.5043	1.7605

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	116.127	C1	C2	H9	108.688
C1	C2	H10	108.688	C1	N3	H7	110.384
C1	N3	H8	110.384	C2	C1	N3	116.127
C2	C1	H11	108.688	C2	C1	H12	108.688
C2	N4	H5	110.384	C2	N4	H6	110.384
N3	C1	H11	108.741	N3	C1	H12	108.741
N4	C2	H9	108.741	N4	C2	H10	108.741
H5	N4	H6	106.708	H7	N3	H8	106.708
H9	C2	H10	105.317	H11	C1	H12	105.317

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: SVWN/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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Number	Element	Mulliken
1	C	-0.247
2	C	-0.247
3	N	-0.455
4	N	-0.455
5	H	0.207
6	H	0.207
7	H	0.207
8	H	0.207
9	H	0.144
10	H	0.144
11	H	0.144
12	H	0.144

	x	y	z
x	6.176	-0.544	0.000
y	-0.544	6.579	0.000
z	0.000	0.000	5.894

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H8N2 (Ethylenediamine)

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

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)