Accuracy
V(Cp)2 (CPNDYV) r
3012 V(Cp)2 (CPNDYV) (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)
UHF PM7
V(Cp)2 (CPNDYV)
<V-C> GR=CCDC
V 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 2.24198600 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.43733242 +1 73.1282944 +1 0.0000000 +0 2 1 0
C 1.43197283 +1 107.7553171 +1 64.2084280 +1 3 2 1
C 1.43325865 +1 108.1511354 +1 0.8013928 +1 4 3 2
C 1.43577806 +1 73.4733392 +1 115.3916504 +1 2 1 3
H 1.08233585 +1 128.5893715 +1 122.4951978 +1 2 1 6
H 1.08059591 +1 125.6968503 +1 171.0862966 +1 3 2 4
H 1.08011322 +1 125.6679524 +1 171.5516657 +1 4 3 5
H 1.08005436 +1 125.5485602 +1 171.6390523 +1 5 4 3
H 1.08053409 +1 125.7334796 +1 124.4313650 +1 6 2 1
C 2.31921060 +1 137.9674330 +1 169.0780543 +1 1 3 2
C 1.43339833 +1 71.9857460 +1 -61.4438202 +1 12 1 6
C 1.43271637 +1 108.0121776 +1 -63.1685520 +1 13 12 1
C 1.43371774 +1 107.9914648 +1 0.1854055 +1 14 13 12
C 1.43248800 +1 71.7145014 +1 -116.7617810 +1 12 1 13
H 1.08018951 +1 129.0359681 +1 -121.5280958 +1 12 1 16
H 1.08009858 +1 125.6858285 +1 -171.2625527 +1 13 12 14
H 1.08026092 +1 125.7206436 +1 -171.1748478 +1 14 13 15
H 1.08043971 +1 125.6372648 +1 -170.6249207 +1 15 14 13
H 1.08031025 +1 125.7295181 +1 -125.7402389 +1 16 12 1