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	hartrees
Energy at 0K	-54.846271
Energy at 298.15K	-54.853335
Nuclear repulsion energy	99.791825

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4000	3650	77.67
2	A'	3751	3423	2.30
3	A'	3213	2932	19.80
4	A'	1866	1703	391.60
5	A'	1857	1695	5.52
6	A'	1609	1468	26.22
7	A'	1534	1400	18.45
8	A'	1404	1281	35.55
9	A'	1248	1139	51.61
10	A'	1200	1095	294.66
11	A'	924	843	64.34
12	A'	785	716	328.52
13	A'	663	605	1.34
14	A'	481	439	49.14
15	A'	264	241	16.17
16	A"	3872	3534	5.97
17	A"	3268	2982	17.02
18	A"	1483	1353	0.11
19	A"	1296	1182	0.66
20	A"	990	903	8.59
21	A"	671	612	194.29
22	A"	546	499	52.73
23	A"	235	214	58.69
24	A"	72	66	5.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.558	0.000
O2	1.180	0.877	0.000
O3	-0.998	1.492	0.000
C4	-0.557	-0.862	0.000
N5	0.444	-1.911	0.000
H6	-0.684	2.395	0.000
H7	-1.201	-0.958	0.867
H8	-1.201	-0.958	-0.867
H9	1.003	-1.962	0.826
H10	1.003	-1.962	-0.826

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2218	1.3670	1.5252	2.5086	1.9599	2.1194	2.1194	2.8350	2.8350
O2	1.2218		2.2632	2.4572	2.8827	2.4037	3.1278	3.1278	2.9614	2.9614
O3	1.3670	2.2632		2.3945	3.6959	0.9562	2.6067	2.6067	4.0760	4.0760
C4	1.5252	2.4572	2.3945		1.4503	3.2590	1.0837	1.0837	2.0798	2.0798
N5	2.5086	2.8827	3.6959	1.4503		4.4510	2.0891	2.0891	0.9984	0.9984
H6	1.9599	2.4037	0.9562	3.2590	4.4510		3.5016	3.5016	4.7441	4.7441
H7	2.1194	3.1278	2.6067	1.0837	2.0891	3.5016		1.7331	2.4215	2.9541
H8	2.1194	3.1278	2.6067	1.0837	2.0891	3.5016	1.7331		2.9541	2.4215
H9	2.8350	2.9614	4.0760	2.0798	0.9984	4.7441	2.4215	2.9541		1.6521
H10	2.8350	2.9614	4.0760	2.0798	0.9984	4.7441	2.9541	2.4215	1.6521

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	113.881	C1	C4	N5	114.905
C1	C4	H7	107.451	C1	C4	H8	107.451
O2	C1	O3	121.808	O2	C1	C4	126.537
O3	C1	C4	111.656	C4	N5	H9	115.031
C4	N5	H10	115.031	N5	C4	H7	110.219
N5	C4	H8	110.219	H7	C4	H8	106.187
H9	N5	H10	111.664

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: HF/CEP-121G

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	0.324
2	O	-0.300
3	O	-0.516
4	C	-0.266
5	N	-0.649
6	H	0.421
7	H	0.197
8	H	0.197
9	H	0.296
10	H	0.296

	x	y	z	Total
	-1.034	0.539	0.000	1.166
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: HF/CEP-121G

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)