Accuracy
tl(iii)c2(plus) (dmtlaz) r
7985 Tl(III)C2(+) (DMTLAZ) (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
Tl(III)C2(+) (DMTLAZ)
<Tl-C> GR=CCDC
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Tl 2.06740000 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 2.27187977 +1 180.0053002 +1 0.0000000 +0 2 1 0
H 1.09727204 +1 109.4953215 +1 -0.1903841 +1 1 2 3
H 1.09728725 +1 109.4959725 +1 -119.9844909 +1 1 2 4
H 1.09734402 +1 109.4939313 +1 -119.9923435 +1 1 2 5
H 1.09047281 +1 104.6086509 +1 0.0219450 +1 3 2 4
H 1.09047856 +1 104.6123159 +1 119.9888613 +1 3 2 7
H 1.09054360 +1 104.6065359 +1 119.9913999 +1 3 2 8