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	hartrees
Energy at 0K	-189.811608
Energy at 298.15K	-189.821993
HF Energy	-189.266011
Nuclear repulsion energy	132.051578

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3603	3335	0.00
2	A_g	3140	2907	0.00
3	A_g	1772	1640	0.00
4	A_g	1579	1462	0.00
5	A_g	1492	1381	0.00
6	A_g	1184	1096	0.00
7	A_g	1138	1054	0.00
8	A_g	912	844	0.00
9	A_g	483	447	0.00
10	A_u	3689	3415	0.09
11	A_u	3198	2961	77.77
12	A_u	1469	1360	1.56
13	A_u	1123	1040	0.40
14	A_u	790	731	0.21
15	A_u	284	263	131.43
16	A_u	156	144	0.26
17	B_g	3690	3416	0.00
18	B_g	3172	2937	0.00
19	B_g	1443	1336	0.00
20	B_g	1374	1272	0.00
21	B_g	991	917	0.00
22	B_g	316	293	0.00
23	B_u	3601	3333	0.28
24	B_u	3144	2911	86.41
25	B_u	1770	1638	58.53
26	B_u	1595	1476	0.77
27	B_u	1402	1298	28.98
28	B_u	1152	1066	11.77
29	B_u	955	884	444.98
30	B_u	290	268	21.34

Atom	x (Å)	y (Å)	z (Å)
C1	0.398	0.653	0.000
C2	-0.398	-0.653	0.000
N3	-0.398	1.874	0.000
N4	0.398	-1.874	0.000
H5	1.004	-1.894	0.810
H6	1.004	-1.894	-0.810
H7	-1.004	1.894	0.810
H8	-1.004	1.894	-0.810
H9	-1.053	-0.677	-0.874
H10	-1.053	-0.677	0.874
H11	1.053	0.677	-0.874
H12	1.053	0.677	0.874

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5292	1.4576	2.5273	2.7406	2.7406	2.0400	2.0400	2.1531	2.1531	1.0926	1.0926
C2	1.5292		2.5273	1.4576	2.0400	2.0400	2.7406	2.7406	1.0926	1.0926	2.1531	2.1531
N3	1.4576	2.5273		3.8321	4.1014	4.1014	1.0122	1.0122	2.7749	2.7749	2.0742	2.0742
N4	2.5273	1.4576	3.8321		1.0122	1.0122	4.1014	4.1014	2.0742	2.0742	2.7749	2.7749
H5	2.7406	2.0400	4.1014	1.0122		1.6209	4.2871	4.5833	2.9239	2.3905	3.0739	2.5718
H6	2.7406	2.0400	4.1014	1.0122	1.6209		4.5833	4.2871	2.3905	2.9239	2.5718	3.0739
H7	2.0400	2.7406	1.0122	4.1014	4.2871	4.5833		1.6209	3.0739	2.5718	2.9239	2.3905
H8	2.0400	2.7406	1.0122	4.1014	4.5833	4.2871	1.6209		2.5718	3.0739	2.3905	2.9239
H9	2.1531	1.0926	2.7749	2.0742	2.9239	2.3905	3.0739	2.5718		1.7487	2.5025	3.0530
H10	2.1531	1.0926	2.7749	2.0742	2.3905	2.9239	2.5718	3.0739	1.7487		3.0530	2.5025
H11	1.0926	2.1531	2.0742	2.7749	3.0739	2.5718	2.9239	2.3905	2.5025	3.0530		1.7487
H12	1.0926	2.1531	2.0742	2.7749	2.5718	3.0739	2.3905	2.9239	3.0530	2.5025	1.7487

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	115.565	C1	C2	H9	109.284
C1	C2	H10	109.284	C1	N3	H7	110.067
C1	N3	H8	110.067	C2	C1	N3	115.565
C2	C1	H11	109.284	C2	C1	H12	109.284
C2	N4	H5	110.067	C2	N4	H6	110.067
N3	C1	H11	107.997	N3	C1	H12	107.997
N4	C2	H9	107.997	N4	C2	H10	107.997
H5	N4	H6	106.395	H7	N3	H8	106.395
H9	C2	H10	106.315	H11	C1	H12	106.315

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: CISD/6-31G*

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 C2H8N2 (Ethylenediamine)

using model chemistry: CISD/6-31G*

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)