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	hartrees
Energy at 0K	-55.710446
Energy at 298.15K	-55.717375
HF Energy	-54.968159
Nuclear repulsion energy	99.239834

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3718	3530	63.95
2	A'	3520	3342	0.96
3	A'	3124	2966	17.07
4	A'	1819	1727	260.57
5	A'	1719	1632	17.92
6	A'	1487	1412	12.11
7	A'	1430	1358	25.34
8	A'	1321	1254	8.95
9	A'	1187	1127	144.63
10	A'	1147	1089	168.42
11	A'	989	939	181.02
12	A'	849	806	41.76
13	A'	628	597	9.09
14	A'	459	436	34.94
15	A'	255	242	8.87
16	A"	3617	3434	2.96
17	A"	3190	3028	10.34
18	A"	1409	1337	0.72
19	A"	1206	1145	0.87
20	A"	925	878	1.14
21	A"	664	630	124.13
22	A"	518	492	33.78
23	A"	246	234	64.04
24	A"	67	64	3.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.560	0.000
O2	1.197	0.851	0.000
O3	-1.000	1.501	0.000
C4	-0.582	-0.865	0.000
N5	0.419	-1.941	0.000
H6	-0.545	2.373	0.000
H7	-1.233	-0.962	0.886
H8	-1.233	-0.962	-0.886
H9	1.031	-1.817	0.814
H10	1.031	-1.817	-0.814

	C1	O2	O3	C4	N5	H6	H7	H8	H9	H10
C1		1.2320	1.3729	1.5388	2.5357	1.8932	2.1495	2.1495	2.7153	2.7153
O2	1.2320		2.2911	2.4715	2.8984	2.3132	3.1584	3.1584	2.7940	2.7940
O3	1.3729	2.2911		2.4018	3.7225	0.9839	2.6274	2.6274	3.9737	3.9737
C4	1.5388	2.4715	2.4018		1.4697	3.2378	1.1037	1.1037	2.0419	2.0419
N5	2.5357	2.8984	3.7225	1.4697		4.4202	2.1145	2.1145	1.0256	1.0256
H6	1.8932	2.3132	0.9839	3.2378	4.4202		3.5184	3.5184	4.5495	4.5495
H7	2.1495	3.1584	2.6274	1.1037	2.1145	3.5184		1.7724	2.4205	2.9569
H8	2.1495	3.1584	2.6274	1.1037	2.1145	3.5184	1.7724		2.9569	2.4205
H9	2.7153	2.7940	3.9737	2.0419	1.0256	4.5495	2.4205	2.9569		1.6273
H10	2.7153	2.7940	3.9737	2.0419	1.0256	4.5495	2.9569	2.4205	1.6273

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	105.704	C1	C4	N5	114.863
C1	C4	H7	107.731	C1	C4	H8	107.731
O2	C1	O3	123.080	O2	C1	C4	125.890
O3	C1	C4	111.030	C4	N5	H9	108.515
C4	N5	H10	108.515	N5	C4	H7	109.688
N5	C4	H8	109.688	H7	C4	H8	106.818
H9	N5	H10	104.990

All results from a given calculation for H₂NCH₂COOH (Glycine)

using model chemistry: MP2/CEP-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	-0.141
2	O	-0.137
3	O	-0.377
4	C	-0.115
5	N	-0.557
6	H	0.439
7	H	0.160
8	H	0.160
9	H	0.283
10	H	0.283

	x	y	z	Total
	-0.578	1.240	0.000	1.368
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2NCH2COOH (Glycine)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for H₂NCH₂COOH (Glycine)