Accuracy
hg(ii)s4 (hgthur) r
7920 Hg(II)S4 (HGTHUR) (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
Hg(II)S4 (HGTHUR)
<Hg-S> <Hg-S><S-Hg-S> <Hg-S><S-Hg-S> GR=CCDC
Hg 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
S 2.48302800 +1 0.0000000 +0 0.0000000 +0 1 0 0
S 2.34479500 +1 171.6051000 +1 0.0000000 +0 1 2 0
S 3.22532000 +1 86.9026920 +1 -108.0488187 +1 1 2 3
N 2.84080925 +1 104.5488768 +1 -106.9501028 +1 2 1 3
N 2.84225008 +1 105.4711753 +1 -143.0190335 +1 3 1 2
N 2.66890689 +1 124.2351938 +1 2.2107593 +1 4 1 2
N 2.33332752 +1 64.8645299 +1 -55.7927458 +1 7 4 1
N 4.12654665 +1 81.9098696 +1 -43.7627001 +1 3 1 6
N 2.33426113 +1 85.7129310 +1 59.3011232 +1 9 3 1
S 2.71262508 +1 63.5988199 +1 -68.3230850 +1 10 9 3
H 0.99956893 +1 157.3823633 +1 0.1272975 +1 7 4 8
H 1.00851876 +1 86.3074044 +1 -177.4073489 +1 7 4 12
H 1.00275156 +1 92.1368131 +1 174.6043622 +1 8 7 4
H 1.01771365 +1 150.5905451 +1 -156.1848799 +1 8 7 14
H 1.00959072 +1 85.9630910 +1 -152.6736934 +1 9 3 10
H 1.00503674 +1 105.3002076 +1 -116.0482876 +1 9 3 16
H 1.01124009 +1 92.6005915 +1 161.0005216 +1 10 9 11
H 1.01312748 +1 149.6868070 +1 -152.1267474 +1 10 9 18
C 1.15953166 +1 2.2169083 +1 -3.8225241 +1 5 2 1
C 1.16136707 +1 30.8571877 +1 -2.1792013 +1 6 1 3
C 1.36336880 +1 33.8334547 +1 179.5523834 +1 7 4 13
C 1.36234768 +1 30.7895873 +1 -7.2405318 +1 10 9 19