Accuracy
tl(iii)c3 (tmettl) r
7987 Tl(III)C3 (TMETTL) (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)
PM7
Tl(III)C3 (TMETTL)
<Tl-C> GR=CCDC
Tl 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 2.30302700 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 2.17338664 +1 120.5795683 +1 0.0000000 +0 1 2 0
C 2.17340919 +1 120.5676855 +1 179.9925993 +1 1 2 3
H 1.07809801 +1 103.9473956 +1 -96.4846317 +1 2 1 3
H 1.07751715 +1 104.7717927 +1 119.8832984 +1 2 1 5
H 1.07764644 +1 104.5506029 +1 120.4239598 +1 2 1 6
H 1.08260401 +1 106.5666464 +1 -50.3142407 +1 4 1 2
H 1.08195860 +1 107.1813235 +1 -120.4544296 +1 4 1 8
H 1.08300546 +1 106.2071496 +1 -120.0970757 +1 4 1 9
H 1.08267528 +1 106.5206170 +1 51.8615758 +1 3 1 2
H 1.08192023 +1 107.2057313 +1 120.4306216 +1 3 1 11
H 1.08301337 +1 106.2231701 +1 120.1309368 +1 3 1 12