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	hartrees
Energy at 0K	-281.787967
Energy at 298.15K	-281.794866
HF Energy	-281.242978
Nuclear repulsion energy	176.602395

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3536	3438	10.21
2	A'	3408	3314	0.28
3	A'	3073	2988	9.37
4	A'	1822	1771	147.16
5	A'	1769	1720	17.49
6	A'	1541	1498	15.89
7	A'	1423	1384	26.13
8	A'	1362	1324	0.07
9	A'	1143	1111	131.11
10	A'	1109	1078	146.20
11	A'	884	859	111.59
12	A'	802	780	159.59
13	A'	639	622	9.62
14	A'	459	446	35.04
15	A'	245	238	10.05
16	A"	3493	3396	0.13
17	A"	3112	3026	6.78
18	A"	1413	1373	0.71
19	A"	1227	1193	0.76
20	A"	939	913	2.19
21	A"	639	621	128.85
22	A"	516	502	54.63
23	A"	232	226	57.55
24	A"	77	75	9.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.546	0.000
O2	1.191	0.837	0.000
O3	-1.014	1.492	0.000
C4	-0.589	-0.864	0.000
N5	0.444	-1.928	0.000
H6	-0.607	2.398	0.000
H7	-1.231	-0.970	0.884
H8	-1.231	-0.970	-0.884
H9	1.040	-1.843	0.829
H10	1.040	-1.843	-0.829

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2257	1.3870	1.5279	2.5141	1.9488	2.1436	2.1436	2.7347	2.7347
O2	1.2257		2.3003	2.4613	2.8643	2.3810	3.1481	3.1481	2.8092	2.8092
O3	1.3870	2.3003		2.3944	3.7186	0.9930	2.6251	2.6251	4.0043	4.0043
C4	1.5279	2.4613	2.3944		1.4830	3.2620	1.0977	1.0977	2.0736	2.0736
N5	2.5141	2.8643	3.7186	1.4830		4.4523	2.1226	2.1226	1.0252	1.0252
H6	1.9488	2.3810	0.9930	3.2620	4.4523		3.5375	3.5375	4.6248	4.6248
H7	2.1436	3.1481	2.6251	1.0977	2.1226	3.5375		1.7671	2.4341	2.9760
H8	2.1436	3.1481	2.6251	1.0977	2.1226	3.5375	1.7671		2.9760	2.4341
H9	2.7347	2.8092	4.0043	2.0736	1.0252	4.6248	2.4341	2.9760		1.6588
H10	2.7347	2.8092	4.0043	2.0736	1.0252	4.6248	2.9760	2.4341	1.6588

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.805	C1	C4	N5	113.223
C1	C4	H7	108.342	C1	C4	H8	108.342
O2	C1	O3	123.268	O2	C1	C4	126.369
O3	C1	C4	110.363	C4	N5	H9	110.197
C4	N5	H10	110.197	N5	C4	H7	109.768
N5	C4	H8	109.768	H7	C4	H8	107.206
H9	N5	H10	108.008

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: CCD/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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All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: CCD/3-21G

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)