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	hartrees
Energy at 0K	-322.620017
Energy at 298.15K	-322.629710
HF Energy	-321.853117
Nuclear repulsion energy	244.981887

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3769	3481	231.59
2	A	3664	3384	5.38
3	A	3272	3022	23.83
4	A	3232	2985	26.99
5	A	3225	2979	15.58
6	A	3177	2934	16.68
7	A	3143	2903	55.06
8	A	2007	1854	370.44
9	A	1617	1494	14.81
10	A	1598	1476	10.86
11	A	1596	1474	24.02
12	A	1581	1460	10.26
13	A	1558	1439	0.79
14	A	1517	1401	468.18
15	A	1448	1337	33.09
16	A	1372	1267	5.82
17	A	1326	1225	3.12
18	A	1266	1170	21.67
19	A	1232	1138	28.41
20	A	1207	1115	14.83
21	A	1070	988	25.63
22	A	1048	968	11.12
23	A	945	873	31.25
24	A	924	853	69.79
25	A	782	722	103.70
26	A	688	636	4.87
27	A	615	568	16.42
28	A	498	460	12.49
29	A	394	364	3.32
30	A	289	267	2.97
31	A	216	200	2.49
32	A	133	123	3.13
33	A	86	79	7.96

Atom	x (Å)	y (Å)	z (Å)
N1	1.195	0.272	-0.310
C2	2.532	-0.071	0.153
C3	0.176	-0.695	0.060
C4	-1.212	-0.073	0.022
O5	-1.216	1.256	0.115
O6	-2.212	-0.724	-0.047
H7	1.209	0.373	-1.315
H8	0.160	-1.600	-0.547
H9	2.871	-1.053	-0.187
H10	3.234	0.679	-0.198
H11	0.348	-1.004	1.090
H12	2.546	-0.062	1.240
H13	-0.288	1.540	0.132

	N1	C2	C3	C4	O5	O6	H7	H8	H9	H10	H11	H12	H13
N1		1.4557	1.4528	2.4541	2.6390	3.5594	1.0101	2.1527	2.1398	2.0822	2.0751	2.0832	2.0013
C2	1.4557		2.4390	3.7459	3.9763	4.7927	2.0258	2.9080	1.0929	1.0862	2.5527	1.0870	3.2482
C3	1.4528	2.4390		1.5210	2.3969	2.3903	2.0237	1.0903	2.7300	3.3627	1.0897	2.7226	2.2838
C4	2.4541	3.7459	1.5210		1.3316	1.1955	2.8008	2.1304	4.2039	4.5144	2.1071	3.9503	1.8618
O5	2.6390	3.9763	2.3969	1.3316		2.2216	2.9506	3.2387	4.7039	4.4987	2.9157	4.1423	0.9709
O6	3.5594	4.7927	2.3903	1.1955	2.2216		3.8091	2.5774	5.0954	5.6260	2.8153	4.9734	2.9763
H7	1.0101	2.0258	2.0237	2.8008	2.9506	3.8091		2.3626	2.4635	2.3333	2.9017	2.9167	2.3872
H8	2.1527	2.9080	1.0903	2.1304	3.2387	2.5774	2.3626		2.7893	3.8431	1.7532	3.3550	3.2443
H9	2.1398	1.0929	2.7300	4.2039	4.7039	5.0954	2.4635	2.7893		1.7697	2.8281	1.7671	4.0997
H10	2.0822	1.0862	3.3627	4.5144	4.4987	5.6260	2.3333	3.8431	1.7697		3.5807	1.7584	3.6413
H11	2.0751	2.5527	1.0897	2.1071	2.9157	2.8153	2.9017	1.7532	2.8281	3.5807		2.3959	2.7917
H12	2.0832	1.0870	2.7226	3.9503	4.1423	4.9734	2.9167	3.3550	1.7671	1.7584	2.3959		3.4395
H13	2.0013	3.2482	2.2838	1.8618	0.9709	2.9763	2.3872	3.2443	4.0997	3.6413	2.7917	3.4395

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H9	113.431	N1	C2	H10	109.139
N1	C2	H12	109.173	N1	C3	C4	111.208
N1	C3	H8	114.924	N1	C3	H11	108.559
C2	N1	C3	113.984	C2	N1	H7	109.151
C3	N1	H7	109.189	C3	C4	O5	114.170
C3	C4	O6	122.817	C4	C3	H8	108.215
C4	C3	H11	106.456	C4	O5	H13	106.877
O5	C4	O6	122.983	H8	C3	H11	107.073
H9	C2	H10	108.611	H9	C2	H12	108.318
H10	C2	H12	108.031

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)

using model chemistry: CID/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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All results from a given calculation for CH3NHCH2COOH (Sarcosine)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)