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	hartrees
Energy at 0K	-322.841847
Energy at 298.15K	-322.851443
HF Energy	-321.867475
Nuclear repulsion energy	243.967774

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3597	3361	7.56
2	A	3565	3331	285.76
3	A	3244	3032	18.62
4	A	3201	2991	22.30
5	A	3186	2977	14.22
6	A	3124	2919	15.20
7	A	3100	2896	54.38
8	A	1883	1760	266.51
9	A	1577	1473	6.66
10	A	1557	1455	13.43
11	A	1541	1440	13.39
12	A	1516	1417	12.88
13	A	1504	1405	0.58
14	A	1447	1352	410.94
15	A	1383	1293	18.75
16	A	1323	1236	4.63
17	A	1266	1183	7.20
18	A	1215	1135	24.80
19	A	1184	1107	29.10
20	A	1165	1089	11.63
21	A	1032	964	22.71
22	A	1007	941	14.22
23	A	927	866	70.86
24	A	901	841	20.34
25	A	797	744	77.78
26	A	655	612	4.19
27	A	582	544	9.59
28	A	478	447	9.19
29	A	384	359	3.88
30	A	288	269	3.80
31	A	213	199	2.35
32	A	137	128	2.69
33	A	82	77	6.84

Atom	x (Å)	y (Å)	z (Å)
N1	1.192	0.267	-0.317
C2	2.529	-0.078	0.163
C3	0.170	-0.710	0.047
C4	-1.215	-0.069	0.022
O5	-1.177	1.274	0.116
O6	-2.244	-0.709	-0.036
H7	1.217	0.351	-1.328
H8	0.148	-1.611	-0.571
H9	2.869	-1.063	-0.169
H10	3.235	0.670	-0.186
H11	0.351	-1.027	1.076
H12	2.527	-0.065	1.250
H13	-0.219	1.491	0.113

	N1	C2	C3	C4	O5	O6	H7	H8	H9	H10	H11	H12	H13
N1		1.4615	1.4604	2.4536	2.6104	3.5828	1.0150	2.1637	2.1458	2.0870	2.0786	2.0848	1.9167
C2	1.4615		2.4449	3.7463	3.9454	4.8184	2.0316	2.9251	1.0934	1.0866	2.5449	1.0874	3.1648
C3	1.4604	2.4449		1.5265	2.3996	2.4154	2.0279	1.0920	2.7309	3.3702	1.0913	2.7238	2.2367
C4	2.4536	3.7463	1.5265		1.3464	1.2134	2.8126	2.1415	4.2078	4.5160	2.1167	3.9380	1.8526
O5	2.6104	3.9454	2.3996	1.3464		2.2567	2.9440	3.2478	4.6816	4.4640	2.9245	4.0987	0.9824
O6	3.5828	4.8184	2.4154	1.2134	2.2567		3.8427	2.6112	5.1273	5.6523	2.8412	4.9830	2.9936
H7	1.0150	2.0316	2.0279	2.8126	2.9440	3.8427		2.3587	2.4643	2.3415	2.9025	2.9214	2.3319
H8	2.1637	2.9251	1.0920	2.1415	3.2478	2.6112	2.3587		2.8052	3.8582	1.7585	3.3713	3.1973
H9	2.1458	1.0934	2.7309	4.2078	4.6816	5.1273	2.4643	2.8052		1.7715	2.8093	1.7684	4.0176
H10	2.0870	1.0866	3.3702	4.5160	4.4640	5.6523	2.3415	3.8582	1.7715		3.5765	1.7616	3.5633
H11	2.0786	2.5449	1.0913	2.1167	2.9245	2.8412	2.9025	1.7585	2.8093	3.5765		2.3855	2.7555
H12	2.0848	1.0874	2.7238	3.9380	4.0987	4.9830	2.9214	3.3713	1.7684	1.7616	2.3855		3.3546
H13	1.9167	3.1648	2.2367	1.8526	0.9824	2.9936	2.3319	3.1973	4.0176	3.5633	2.7555	3.3546

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H9	113.467	N1	C2	H10	109.085
N1	C2	H12	108.863	N1	C3	C4	110.440
N1	C3	H8	115.168	N1	C3	H11	108.226
C2	N1	C3	113.593	C2	N1	H7	108.898
C3	N1	H7	108.678	C3	C4	O5	113.135
C3	C4	O6	123.250	C4	C3	H8	108.595
C4	C3	H11	106.735	C4	O5	H13	104.317
O5	C4	O6	123.581	H8	C3	H11	107.308
H9	C2	H10	108.699	H9	C2	H12	108.359
H10	C2	H12	108.245

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for CH₃NHCH₂COOH (Sarcosine)