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	hartrees
Energy at 0K	-1071.792493
Energy at 298.15K
HF Energy	-1070.831423
Nuclear repulsion energy	267.043093

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3177	3001	4.57
2	A	3033	2866	41.15
3	A	1903	1798	121.16
4	A	1434	1355	14.76
5	A	1302	1230	9.38
6	A	1248	1179	12.72
7	A	1067	1008	13.23
8	A	968	914	6.22
9	A	854	807	67.49
10	A	666	630	30.87
11	A	635	600	31.27
12	A	352	332	1.15
13	A	279	263	3.52
14	A	223	211	2.98
15	A	89	84	10.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.097	-0.025	0.519
C2	-0.709	-1.280	0.193
H3	0.224	0.057	1.592
Cl4	1.728	-0.257	-0.167
Cl5	-0.674	1.444	-0.058
O6	-1.785	-1.277	-0.316
H7	-0.189	-2.204	0.485

	C1	C2	H3	Cl4	Cl5	O6	H7
C1		1.5262	1.0837	1.7842	1.7569	2.4095	2.1976
C2	1.5262		2.1476	2.6667	2.7357	1.1906	1.0994
H3	1.0837	2.1476		2.3359	2.3354	3.0747	2.5508
Cl4	1.7842	2.6667	2.3359		2.9449	3.6606	2.8090
Cl5	1.7569	2.7357	2.3354	2.9449		2.9504	3.7199
O6	2.4095	1.1906	3.0747	3.6606	2.9504		2.0116
H7	2.1976	1.0994	2.5508	2.8090	3.7199	2.0116

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O6	124.509	C1	C2	H7	112.639
C2	C1	H3	109.584	C2	C1	Cl4	107.074
C2	C1	Cl5	112.689	H3	C1	Cl4	106.505
H3	C1	Cl5	108.258	Cl4	C1	Cl5	112.533
O6	C2	H7	122.852

All results from a given calculation for CHCl₂CHO (dichloroacetaldehyde)

using model chemistry: MP3/cc-pVTZ

States and conformations

Conformer 1 (C1)

Conformer 2 (C1)

	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 CHCl2CHO (dichloroacetaldehyde)

using model chemistry: MP3/cc-pVTZ

States and conformations

Conformer 1 (C1)

Conformer 2 (C1)

All results from a given calculation for CHCl₂CHO (dichloroacetaldehyde)