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	hartrees
Energy at 0K	-188.454499
Energy at 298.15K	-188.464388
Nuclear repulsion energy	131.269076

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3361	3361	0.00
2	A_g	2942	2942	0.00
3	A_g	1656	1656	0.00
4	A_g	1458	1458	0.00
5	A_g	1342	1342	0.00
6	A_g	1121	1121	0.00
7	A_g	1014	1014	0.00
8	A_g	601	601	0.00
9	A_g	455	455	0.00
10	A_u	3465	3465	0.04
11	A_u	3014	3014	53.45
12	A_u	1352	1352	4.50
13	A_u	1058	1058	0.05
14	A_u	739	739	3.40
15	A_u	262	262	142.66
16	A_u	156	156	0.00
17	B_g	3465	3465	0.00
18	B_g	2982	2982	0.00
19	B_g	1339	1339	0.00
20	B_g	1278	1278	0.00
21	B_g	917	917	0.00
22	B_g	298	298	0.00
23	B_u	3360	3360	1.13
24	B_u	2955	2955	79.85
25	B_u	1657	1657	52.43
26	B_u	1478	1478	3.96
27	B_u	1289	1289	3.16
28	B_u	1114	1114	16.18
29	B_u	600	600	616.96
30	B_u	235	235	32.52

Atom	x (Å)	y (Å)	z (Å)
C1	0.400	0.655	0.000
C2	-0.400	-0.655	0.000
N3	-0.400	1.867	0.000
N4	0.400	-1.867	0.000
H5	0.978	-1.965	0.847
H6	0.978	-1.965	-0.847
H7	-0.978	1.965	0.847
H8	-0.978	1.965	-0.847
H9	-1.065	-0.660	-0.888
H10	-1.065	-0.660	0.888
H11	1.065	0.660	-0.888
H12	1.065	0.660	0.888

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5354	1.4522	2.5228	2.8142	2.8142	2.0815	2.0815	2.1595	2.1595	1.1093	1.1093
C2	1.5354		2.5228	1.4522	2.0815	2.0815	2.8142	2.8142	1.1093	1.1093	2.1595	2.1595
N3	1.4522	2.5228		3.8196	4.1602	4.1602	1.0301	1.0301	2.7601	2.7601	2.0956	2.0956
N4	2.5228	1.4522	3.8196		1.0301	1.0301	4.1602	4.1602	2.0956	2.0956	2.7601	2.7601
H5	2.8142	2.0815	4.1602	1.0301		1.6936	4.3907	4.7061	2.9811	2.4247	3.1479	2.6271
H6	2.8142	2.0815	4.1602	1.0301	1.6936		4.7061	4.3907	2.4247	2.9811	2.6271	3.1479
H7	2.0815	2.8142	1.0301	4.1602	4.3907	4.7061		1.6936	3.1479	2.6271	2.9811	2.4247
H8	2.0815	2.8142	1.0301	4.1602	4.7061	4.3907	1.6936		2.6271	3.1479	2.4247	2.9811
H9	2.1595	1.1093	2.7601	2.0956	2.9811	2.4247	3.1479	2.6271		1.7760	2.5052	3.0709
H10	2.1595	1.1093	2.7601	2.0956	2.4247	2.9811	2.6271	3.1479	1.7760		3.0709	2.5052
H11	1.1093	2.1595	2.0956	2.7601	3.1479	2.6271	2.9811	2.4247	2.5052	3.0709		1.7760
H12	1.1093	2.1595	2.0956	2.7601	2.6271	3.1479	2.4247	2.9811	3.0709	2.5052	1.7760

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	115.193	C1	C2	H9	108.403
C1	C2	H10	108.403	C1	N3	H7	112.864
C1	N3	H8	112.864	C2	C1	N3	115.193
C2	C1	H11	108.403	C2	C1	H12	108.403
C2	N4	H5	112.864	C2	N4	H6	112.864
N3	C1	H11	109.062	N3	C1	H12	109.062
N4	C2	H9	109.062	N4	C2	H10	109.062
H5	N4	H6	110.581	H7	N3	H8	110.581
H9	C2	H10	106.357	H11	C1	H12	106.357

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: SVWN/3-21G*

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	-0.312
2	C	-0.312
3	N	-0.652
4	N	-0.652
5	H	0.275
6	H	0.275
7	H	0.275
8	H	0.275
9	H	0.207
10	H	0.207
11	H	0.207
12	H	0.207

	x	y	z
x	4.788	-0.904	0.000
y	-0.904	5.151	0.000
z	0.000	0.000	5.097

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H8N2 (Ethylenediamine)

using model chemistry: SVWN/3-21G*

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)