Accuracy
ga(iii)(c6)(plus) (cuttug) r
3787 Ga(III)(C6)(+) (CUTTUG) (Geo)
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REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
CHARGE=1 PM7
Ga(III)(C6)(+) (CUTTUG)
<Ga-C> GR=CCDC
Ga 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 2.80804700 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.40425470 +1 87.2678083 +1 0.0000000 +0 2 1 0
C 1.49515645 +1 102.1920944 +1 -119.9244760 +1 2 1 3
C 1.49173027 +1 121.3472029 +1 -99.5570190 +1 3 2 1
C 2.43053683 +1 85.7394094 +1 -150.0336500 +1 2 1 4
C 1.40634502 +1 120.1733844 +1 -176.8472842 +1 3 2 5
C 1.40895686 +1 87.9981376 +1 29.9574229 +1 2 1 6
C 1.39969541 +1 119.8753877 +1 1.8157721 +1 7 3 2
C 1.49197927 +1 151.3906960 +1 100.7354224 +1 6 2 1
C 1.49116715 +1 118.6403233 +1 176.8227213 +1 7 3 9
C 1.49194971 +1 120.5018606 +1 98.0306424 +1 8 2 1
C 1.49088440 +1 121.4840947 +1 178.4691138 +1 9 7 3
H 1.09807332 +1 114.3707082 +1 -64.3925336 +1 4 2 1
H 1.10974317 +1 109.1012212 +1 -117.6535229 +1 4 2 14
H 1.09749989 +1 114.2824553 +1 -118.2505199 +1 4 2 15
H 1.09887152 +1 113.0050118 +1 131.7243750 +1 5 3 2
H 1.09738216 +1 114.6936063 +1 -123.1176050 +1 5 3 17
H 1.10836568 +1 109.8516473 +1 -118.4114056 +1 5 3 18
H 1.09821552 +1 114.2919364 +1 1.9494719 +1 10 6 2
H 1.10609865 +1 110.8584680 +1 118.7234012 +1 10 6 20
H 1.09980173 +1 112.0685560 +1 119.3712064 +1 10 6 21
H 1.10073072 +1 113.9111157 +1 171.4049893 +1 11 7 3
H 1.10590759 +1 110.4195739 +1 118.9996899 +1 11 7 23
H 1.09869086 +1 112.8198959 +1 119.7234987 +1 11 7 24
H 1.09978547 +1 113.0914060 +1 -143.2906557 +1 12 8 2
H 1.10780198 +1 109.8499587 +1 -118.9475098 +1 12 8 26
H 1.09751756 +1 114.4710983 +1 -118.7302572 +1 12 8 27
H 1.10014808 +1 112.4982799 +1 135.4670274 +1 13 9 7
H 1.10572761 +1 110.6057630 +1 119.6713320 +1 13 9 29
H 1.10035138 +1 113.9012116 +1 119.4903833 +1 13 9 30