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	hartrees
Energy at 0K	-281.247498
Energy at 298.15K	-281.254602
Nuclear repulsion energy	179.478842

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3868	3491	66.32
2	A'	3688	3328	3.13
3	A'	3241	2925	9.76
4	A'	1968	1776	262.51
5	A'	1861	1680	27.92
6	A'	1619	1461	23.65
7	A'	1514	1367	36.41
8	A'	1440	1300	12.08
9	A'	1222	1103	240.45
10	A'	1177	1063	81.13
11	A'	915	826	52.11
12	A'	795	717	323.01
13	A'	684	617	3.78
14	A'	494	446	40.24
15	A'	261	235	14.28
16	A"	3780	3412	7.09
17	A"	3278	2959	5.84
18	A"	1493	1348	0.02
19	A"	1306	1179	1.58
20	A"	996	899	11.53
21	A"	682	616	161.43
22	A"	545	492	66.06
23	A"	244	221	59.07
24	A"	95	86	8.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.542	0.000
O2	1.164	0.843	0.000
O3	-0.997	1.463	0.000
C4	-0.570	-0.854	0.000
N5	0.446	-1.893	0.000
H6	-0.657	2.370	0.000
H7	-1.208	-0.955	0.868
H8	-1.208	-0.955	-0.868
H9	1.017	-1.891	0.825
H10	1.017	-1.891	-0.825

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2019	1.3567	1.5087	2.4764	1.9426	2.1108	2.1108	2.7636	2.7636
O2	1.2019		2.2476	2.4264	2.8289	2.3769	3.1003	3.1003	2.8595	2.8595
O3	1.3567	2.2476		2.3563	3.6535	0.9687	2.5778	2.5778	3.9982	3.9982
C4	1.5087	2.4264	2.3563		1.4536	3.2259	1.0822	1.0822	2.0678	2.0678
N5	2.4764	2.8289	3.6535	1.4536		4.4043	2.0910	2.0910	1.0036	1.0036
H6	1.9426	2.3769	0.9687	3.2259	4.4043		3.4806	3.4806	4.6523	4.6523
H7	2.1108	3.1003	2.5778	1.0822	2.0910	3.4806		1.7369	2.4145	2.9491
H8	2.1108	3.1003	2.5778	1.0822	2.0910	3.4806	1.7369		2.9491	2.4145
H9	2.7636	2.8595	3.9982	2.0678	1.0036	4.6523	2.4145	2.9491		1.6509
H10	2.7636	2.8595	3.9982	2.0678	1.0036	4.6523	2.9491	2.4145	1.6509

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	112.231	C1	C4	N5	113.422
C1	C4	H7	107.980	C1	C4	H8	107.980
O2	C1	O3	122.790	O2	C1	C4	126.685
O3	C1	C4	110.524	C4	N5	H9	113.329
C4	N5	H10	113.329	N5	C4	H7	110.233
N5	C4	H8	110.233	H7	C4	H8	106.737
H9	N5	H10	110.661

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: HF/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	0.823
2	O	-0.607
3	O	-0.720
4	C	-0.298
5	N	-0.772
6	H	0.413
7	H	0.268
8	H	0.268
9	H	0.312
10	H	0.312

	x	y	z	Total
	-0.733	0.902	0.000	1.162
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: HF/3-21G*

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)