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	hartrees
Energy at 0K	-249.924099
Energy at 298.15K
HF Energy	-249.013784
Nuclear repulsion energy	239.967302

Atom	x (Å)	y (Å)	z (Å)
H1	-1.443	2.073	0.135
C2	-0.797	1.206	0.057
H3	0.962	2.347	-0.093
C4	0.528	1.356	-0.050
H5	2.337	0.358	0.523
H6	1.858	0.068	-1.133
C7	1.470	0.178	-0.115
H8	0.628	-1.105	1.401
H9	1.351	-1.985	0.065
C10	0.753	-1.108	0.316
H11	-2.319	-0.168	-0.576
H12	-1.851	-0.342	1.098
C13	-1.457	-0.155	0.093
H14	-0.478	-1.278	-1.285
N15	-0.574	-1.260	-0.277

	H1	C2	H3	C4	H5	H6	C7	H8	H9	C10	H11	H12	C13	H14	N15
H1		1.0837	2.4311	2.1050	4.1690	4.0648	3.4836	3.9981	4.9264	3.8694	2.5091	2.6313	2.2282	3.7647	3.4688
C2	1.0837		2.1023	1.3376	3.2806	3.1242	2.4950	3.0292	3.8460	2.7973	2.1457	2.1426	1.5130	2.8409	2.4985
H3	2.4311	2.1023		1.0832	2.4959	2.6606	2.2283	3.7762	4.3520	3.4859	4.1624	4.0698	3.4855	4.0789	3.9253
C4	2.1050	1.3376	1.0832		2.1445	2.1451	1.5098	2.8581	3.4421	2.5013	3.2716	3.1399	2.4987	3.0782	2.8479
H5	4.1690	3.2806	2.4959	2.1445		1.7482	1.0925	2.4151	2.5826	2.1687	4.8131	4.2853	3.8531	3.7250	3.4260
H6	4.0648	3.1242	2.6606	2.1451	1.7482		1.0946	3.0513	2.4300	2.1690	4.2207	4.3479	3.5420	2.7010	2.9007
C7	3.4836	2.4950	2.2283	1.5098	1.0925	1.0946		2.1571	2.1729	1.5340	3.8320	3.5734	2.9530	2.6985	2.5043
H8	3.9981	3.0292	3.7762	2.8581	2.4151	3.0513	2.1571		1.7557	1.0924	3.6698	2.6112	2.6379	2.9103	2.0703
H9	4.9264	3.8460	4.3520	3.4421	2.5826	2.4300	2.1729	1.7557		1.0901	4.1443	3.7440	3.3515	2.3809	2.0852
C10	3.8694	2.7973	3.4859	2.5013	2.1687	2.1690	1.5340	1.0924	1.0901		3.3338	2.8249	2.4171	2.0270	1.4617
H11	2.5091	2.1457	4.1624	3.2716	4.8131	4.2207	3.8320	3.6698	4.1443	3.3338		1.7466	1.0912	2.2629	2.0796
H12	2.6313	2.1426	4.0698	3.1399	4.2853	4.3479	3.5734	2.6112	3.7440	2.8249	1.7466		1.0950	2.9050	2.0892
C13	2.2282	1.5130	3.4855	2.4987	3.8531	3.5420	2.9530	2.6379	3.3515	2.4171	1.0912	1.0950		2.0295	1.4622
H14	3.7647	2.8409	4.0789	3.0782	3.7250	2.7010	2.6985	2.9103	2.3809	2.0270	2.2629	2.9050	2.0295		1.0126
N15	3.4688	2.4985	3.9253	2.8479	3.4260	2.9007	2.5043	2.0703	2.0852	1.4617	2.0796	2.0892	1.4622	1.0126

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	120.408	H1	C2	C13	117.248
C2	C4	H3	120.190	C2	C4	C7	122.264
C2	C13	H11	109.910	C2	C13	H12	109.436
C2	C13	N15	114.224	H3	C4	C7	117.546
C4	C2	C13	122.338	C4	C7	H5	109.957
C4	C7	H6	109.881	C4	C7	C10	110.517
H5	C7	H6	106.132	H5	C7	C10	110.181
H6	C7	C10	110.082	C7	C10	H8	109.275
C7	C10	H9	110.655	C7	C10	N15	113.405
H8	C10	H9	107.117	H8	C10	N15	107.424
H9	C10	N15	108.726	C10	N15	C13	111.515
C10	N15	H14	108.655	H11	C13	H12	106.050
H11	C13	N15	108.180	H12	C13	N15	108.713
C13	N15	H14	108.820

All results from a given calculation for C₅H₉N (1,2,3,6-Tetrahydropyridine)

using model chemistry: MP3/6-31+G**

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 C5H9N (1,2,3,6-Tetrahydropyridine)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for C₅H₉N (1,2,3,6-Tetrahydropyridine)