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	hartrees
Energy at 0K	-282.698013
Energy at 298.15K	-282.705132
Nuclear repulsion energy	179.416893

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3992	3604	93.54
2	A'	3803	3434	7.09
3	A'	3230	2916	13.75
4	A'	1922	1736	328.19
5	A'	1861	1681	37.65
6	A'	1618	1461	24.53
7	A'	1548	1398	26.61
8	A'	1437	1297	35.62
9	A'	1261	1138	81.07
10	A'	1220	1102	251.44
11	A'	933	843	36.82
12	A'	745	673	379.32
13	A'	680	614	16.83
14	A'	501	452	48.74
15	A'	275	249	19.65
16	A"	3918	3537	15.81
17	A"	3274	2956	8.64
18	A"	1496	1351	0.39
19	A"	1304	1178	0.44
20	A"	1000	903	13.56
21	A"	688	621	200.41
22	A"	556	502	55.24
23	A"	247	223	54.82
24	A"	87	78	5.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.547	0.000
O2	1.171	0.853	0.000
O3	-0.985	1.474	0.000
C4	-0.557	-0.854	0.000
N5	0.428	-1.896	0.000
H6	-0.673	2.376	0.000
H7	-1.203	-0.949	0.864
H8	-1.203	-0.949	-0.864
H9	0.972	-1.984	0.828
H10	0.972	-1.984	-0.828

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2104	1.3530	1.5074	2.4801	1.9490	2.1048	2.1048	2.8348	2.8348
O2	1.2104		2.2441	2.4290	2.8478	2.3919	3.1030	3.1030	2.9620	2.9620
O3	1.3530	2.2441		2.3667	3.6543	0.9545	2.5812	2.5812	4.0590	4.0590
C4	1.5074	2.4290	2.3667		1.4341	3.2317	1.0828	1.0828	2.0742	2.0742
N5	2.4801	2.8478	3.6543	1.4341		4.4116	2.0744	2.0744	0.9947	0.9947
H6	1.9490	2.3919	0.9545	3.2317	4.4116		3.4756	3.4756	4.7331	4.7331
H7	2.1048	3.1030	2.5812	1.0828	2.0744	3.4756		1.7283	2.4093	2.9437
H8	2.1048	3.1030	2.5812	1.0828	2.0744	3.4756	1.7283		2.9437	2.4093
H9	2.8348	2.9620	4.0590	2.0742	0.9947	4.7331	2.4093	2.9437		1.6555
H10	2.8348	2.9620	4.0590	2.0742	0.9947	4.7331	2.9437	2.4093	1.6555

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	114.162	C1	C4	N5	114.923
C1	C4	H7	107.572	C1	C4	H8	107.572
O2	C1	O3	122.102	O2	C1	C4	126.346
O3	C1	C4	111.552	C4	N5	H9	116.123
C4	N5	H10	116.123	N5	C4	H7	110.228
N5	C4	H8	110.228	H7	C4	H8	105.884
H9	N5	H10	112.644

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: HF/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	0.721
2	O	-0.553
3	O	-0.730
4	C	-0.178
5	N	-0.821
6	H	0.441
7	H	0.221
8	H	0.221
9	H	0.339
10	H	0.339

	x	y	z	Total
	-0.950	0.500	0.000	1.074
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: HF/6-31G

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)