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	hartrees
Energy at 0K	-191.359858
Energy at 298.15K
HF Energy	-190.764543
Nuclear repulsion energy	102.163573

Atom	x (Å)	y (Å)	z (Å)
C1	-0.765	0.127	-0.000
C2	0.476	0.575	-0.000
C3	1.680	-0.335	0.000
O4	-1.865	-0.268	0.000
H5	0.596	1.647	0.000
H6	1.379	-1.380	-0.000
H7	2.297	-0.165	-0.882
H8	2.296	-0.166	0.882

	C1	C2	C3	O4	H5	H6	H7	H8
C1		1.3191	2.4883	1.1689	2.0399	2.6201	3.1993	3.1990
C2	1.3191		1.5095	2.4880	1.0786	2.1534	2.1542	2.1543
C3	2.4883	1.5095		3.5459	2.2594	1.0877	1.0891	1.0891
O4	1.1689	2.4880	3.5459		3.1178	3.4289	4.2553	4.2549
H5	2.0399	1.0786	2.2594	3.1178		3.1267	2.6375	2.6375
H6	2.6201	2.1534	1.0877	3.4289	3.1267		1.7593	1.7593
H7	3.1993	2.1542	1.0891	4.2553	2.6375	1.7593		1.7637
H8	3.1990	2.1543	1.0891	4.2549	2.6375	1.7593	1.7637

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.063	C1	C2	H5	116.229
C2	C1	O4	179.875	C2	C3	H6	110.975
C2	C3	H7	110.957	C2	C3	H8	110.961
C3	C2	H5	120.707	H6	C3	H7	107.837
H6	C3	H8	107.838	H7	C3	H8	108.139

All results from a given calculation for C₃H₄O (Methylketene)

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 C3H4O (Methylketene)

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

States and conformations

All results from a given calculation for C₃H₄O (Methylketene)