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	hartrees
Energy at 0K	-282.753483
Energy at 298.15K	-282.760506
Nuclear repulsion energy	178.485464

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4029	3626	98.34
2	A'	3808	3427	6.39
3	A'	3261	2935	21.75
4	A'	1892	1703	379.47
5	A'	1851	1665	35.88
6	A'	1618	1456	30.08
7	A'	1539	1385	18.66
8	A'	1412	1271	30.84
9	A'	1252	1127	34.74
10	A'	1207	1086	317.76
11	A'	924	832	45.69
12	A'	739	665	379.34
13	A'	667	600	8.17
14	A'	489	440	50.74
15	A'	267	240	19.14
16	A"	3931	3537	15.35
17	A"	3317	2985	16.71
18	A"	1483	1335	0.33
19	A"	1298	1168	0.65
20	A"	998	898	13.37
21	A"	679	611	200.66
22	A"	550	495	60.92
23	A"	230	207	55.45
24	A"	77	69	6.29

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.551	0.000
O2	1.172	0.871	0.000
O3	-0.998	1.474	0.000
C4	-0.555	-0.863	0.000
N5	0.439	-1.910	0.000
H6	-0.701	2.383	0.000
H7	-1.198	-0.958	0.864
H8	-1.198	-0.958	-0.864
H9	0.985	-1.995	0.830
H10	0.985	-1.995	-0.830

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2146	1.3599	1.5188	2.4995	1.9618	2.1115	2.1115	2.8533	2.8533
O2	1.2146		2.2525	2.4466	2.8754	2.4073	3.1155	3.1155	2.9894	2.9894
O3	1.3599	2.2525		2.3789	3.6766	0.9564	2.5886	2.5886	4.0816	4.0816
C4	1.5188	2.4466	2.3789		1.4433	3.2495	1.0814	1.0814	2.0835	2.0835
N5	2.4995	2.8754	3.6766	1.4433		4.4417	2.0816	2.0816	0.9970	0.9970
H6	1.9618	2.4073	0.9564	3.2495	4.4417		3.4865	3.4865	4.7646	4.7646
H7	2.1115	3.1155	2.5886	1.0814	2.0816	3.4865		1.7278	2.4174	2.9515
H8	2.1115	3.1155	2.5886	1.0814	2.0816	3.4865	1.7278		2.9515	2.4174
H9	2.8533	2.9894	4.0816	2.0835	0.9970	4.7646	2.4174	2.9515		1.6594
H10	2.8533	2.9894	4.0816	2.0835	0.9970	4.7646	2.9515	2.4174	1.6594

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	114.642	C1	C4	N5	115.072
C1	C4	H7	107.394	C1	C4	H8	107.394
O2	C1	O3	121.977	O2	C1	C4	126.685
O3	C1	C4	111.338	C4	N5	H9	116.055
C4	N5	H10	116.055	N5	C4	H7	110.250
N5	C4	H8	110.250	H7	C4	H8	106.042
H9	N5	H10	112.658

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: HF/LANL2DZ

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	0.483
2	O	-0.407
3	O	-0.610
4	C	-0.280
5	N	-0.713
6	H	0.438
7	H	0.225
8	H	0.225
9	H	0.319
10	H	0.319

	x	y	z	Total
	-1.023	0.541	0.000	1.157
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: HF/LANL2DZ

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)