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	hartrees
Energy at 0K	-189.438864
Energy at 298.15K	-189.448490
Nuclear repulsion energy	131.575614

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3522	3522	0.00
2	A_g	2943	2943	0.00
3	A_g	1639	1639	0.00
4	A_g	1450	1450	0.00
5	A_g	1360	1360	0.00
6	A_g	1160	1160	0.00
7	A_g	1043	1043	0.00
8	A_g	508	508	0.00
9	A_g	427	427	0.00
10	A_u	3644	3644	8.97
11	A_u	3017	3017	74.35
12	A_u	1332	1332	0.07
13	A_u	1023	1023	3.19
14	A_u	741	741	4.25
15	A_u	226	226	103.65
16	A_u	145	145	0.88
17	B_g	3644	3644	0.00
18	B_g	2987	2987	0.00
19	B_g	1324	1324	0.00
20	B_g	1258	1258	0.00
21	B_g	901	901	0.00
22	B_g	260	260	0.00
23	B_u	3521	3521	3.55
24	B_u	2956	2956	110.82
25	B_u	1641	1641	80.16
26	B_u	1468	1468	3.84
27	B_u	1301	1301	5.66
28	B_u	1157	1157	51.03
29	B_u	477	477	746.74
30	B_u	250	250	62.64

Atom	x (Å)	y (Å)	z (Å)
C1	0.395	0.657	0.000
C2	-0.395	-0.657	0.000
N3	-0.395	1.857	0.000
N4	0.395	-1.857	0.000
H5	0.901	-2.081	0.854
H6	0.901	-2.081	-0.854
H7	-0.901	2.081	0.854
H8	-0.901	2.081	-0.854
H9	-1.069	-0.660	-0.882
H10	-1.069	-0.660	0.882
H11	1.069	0.660	-0.882
H12	1.069	0.660	0.882

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5328	1.4374	2.5138	2.9115	2.9115	2.1065	2.1065	2.1575	2.1575	1.1099	1.1099
C2	1.5328		2.5138	1.4374	2.1065	2.1065	2.9115	2.9115	1.1099	1.1099	2.1575	2.1575
N3	1.4374	2.5138		3.7976	4.2327	4.2327	1.0173	1.0173	2.7509	2.7509	2.0870	2.0870
N4	2.5138	1.4374	3.7976		1.0173	1.0173	4.2327	4.2327	2.0870	2.0870	2.7509	2.7509
H5	2.9115	2.1065	4.2327	1.0173		1.7076	4.5347	4.8455	2.9855	2.4292	3.2482	2.7457
H6	2.9115	2.1065	4.2327	1.0173	1.7076		4.8455	4.5347	2.4292	2.9855	2.7457	3.2482
H7	2.1065	2.9115	1.0173	4.2327	4.5347	4.8455		1.7076	3.2482	2.7457	2.9855	2.4292
H8	2.1065	2.9115	1.0173	4.2327	4.8455	4.5347	1.7076		2.7457	3.2482	2.4292	2.9855
H9	2.1575	1.1099	2.7509	2.0870	2.9855	2.4292	3.2482	2.7457		1.7641	2.5124	3.0699
H10	2.1575	1.1099	2.7509	2.0870	2.4292	2.9855	2.7457	3.2482	1.7641		3.0699	2.5124
H11	1.1099	2.1575	2.0870	2.7509	3.2482	2.7457	2.9855	2.4292	2.5124	3.0699		1.7641
H12	1.1099	2.1575	2.0870	2.7509	2.7457	3.2482	2.4292	2.9855	3.0699	2.5124	1.7641

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	115.597	C1	C2	H9	108.392
C1	C2	H10	108.392	C1	N3	H7	117.187
C1	N3	H8	117.187	C2	C1	N3	115.597
C2	C1	H11	108.392	C2	C1	H12	108.392
C2	N4	H5	117.187	C2	N4	H6	117.187
N3	C1	H11	109.352	N3	C1	H12	109.352
N4	C2	H9	109.352	N4	C2	H10	109.352
H5	N4	H6	114.128	H7	N3	H8	114.128
H9	C2	H10	105.251	H11	C1	H12	105.251

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: SVWN/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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Number	Element	Mulliken
1	C	-0.200
2	C	-0.200
3	N	-0.707
4	N	-0.707
5	H	0.301
6	H	0.301
7	H	0.301
8	H	0.301
9	H	0.153
10	H	0.153
11	H	0.153
12	H	0.153

	x	y	z
x	4.950	-0.865	0.000
y	-0.865	5.667	0.000
z	0.000	0.000	5.319

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H8N2 (Ethylenediamine)

using model chemistry: SVWN/6-31G

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)