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	hartrees
Energy at 0K	-3831.228029
Energy at 298.15K	-3831.235449
HF Energy	-3831.130687
Nuclear repulsion energy	289.667481

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1890	1804	0.00
2	A_g	1496	1428	0.00
3	A_g	802	765	0.00
4	A_g	217	208	0.00
5	A_u	446	426	0.00
6	B_1g	1889	1803	0.00
7	B_1g	474	452	0.00
8	B_1u	1193	1139	375.59
9	B_1u	638	609	203.01
10	B_2g	1340	1279	0.00
11	B_2g	375	358	0.00
12	B_2u	1895	1809	416.87
13	B_2u	886	846	313.08
14	B_2u	247	236	6.30
15	B_3g	758	723	0.00
16	B_3u	1883	1797	109.56
17	B_3u	1416	1352	1278.27
18	B_3u	750	716	744.50

Atom	x (Å)	y (Å)	z (Å)
Ga1	1.334	0.000	0.000
Ga2	-1.334	0.000	0.000
H3	0.000	0.000	1.178
H4	0.000	0.000	-1.178
H5	2.027	1.415	0.000
H6	2.027	-1.415	0.000
H7	-2.027	1.415	0.000
H8	-2.027	-1.415	0.000

	Ga1	Ga2	H3	H4	H5	H6	H7	H8
Ga1		2.6688	1.7802	1.7802	1.5756	1.5756	3.6472	3.6472
Ga2	2.6688		1.7802	1.7802	3.6472	3.6472	1.5756	1.5756
H3	1.7802	1.7802		2.3567	2.7387	2.7387	2.7387	2.7387
H4	1.7802	1.7802	2.3567		2.7387	2.7387	2.7387	2.7387
H5	1.5756	3.6472	2.7387	2.7387		2.8302	4.0543	4.9444
H6	1.5756	3.6472	2.7387	2.7387	2.8302		4.9444	4.0543
H7	3.6472	1.5756	2.7387	2.7387	4.0543	4.9444		2.8302
H8	3.6472	1.5756	2.7387	2.7387	4.9444	4.0543	2.8302

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Ga1	Ga2	H3	41.446	Ga1	Ga2	H4	41.446
Ga1	Ga2	H7	116.083	Ga1	Ga2	H8	116.083
Ga1	H3	Ga2	97.108	Ga1	H4	Ga2	97.108
Ga2	Ga1	H3	41.446	Ga2	Ga1	H4	41.446
Ga2	Ga1	H5	116.083	Ga2	Ga1	H6	116.083
H3	Ga1	H4	82.892	H3	Ga1	H5	109.243
H3	Ga1	H6	109.243	H3	Ga2	H4	82.892
H3	Ga2	H7	109.243	H3	Ga2	H8	109.243
H4	Ga1	H5	109.243	H4	Ga1	H6	109.243
H4	Ga2	H7	109.243	H4	Ga2	H8	109.243
H5	Ga1	H6	127.834	H7	Ga2	H8	127.834

All results from a given calculation for Ga₂H₆ (digallane)

using model chemistry: MP2/3-21G

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 Ga2H6 (digallane)

using model chemistry: MP2/3-21G

States and conformations

All results from a given calculation for Ga₂H₆ (digallane)