Accuracy
K(I)O6(plus) (AQEPIV) r
2688 K(I)O6(+) (AQEPIV) (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
K(I)O6(+) (AQEPIV)
<K-O> <K-O><O-K-O> GR=CCDC
K 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
O 2.89521100 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 2.78212900 +1 60.1800370 +1 0.0000000 +0 1 2 0
O -1.47127013 +1 2.4517197 +1 -0.5608729 +1 0 0 0
O -2.92528221 +1 -0.0064327 +1 0.0722701 +1 0 0 0
O -1.43359728 +1 -2.5401362 +1 -0.0575493 +1 0 0 0
O 1.43339809 +1 -2.4719264 +1 0.5732313 +1 0 0 0
C 2.74713882 +1 -2.3375017 +1 0.0366616 +1 0 0 0
H 2.69930882 +1 -2.1835788 +1 -1.0578874 +1 0 0 0
H 3.32144516 +1 -3.2568012 +1 0.2575000 +1 0 0 0
C 3.33941917 +1 -1.1238635 +1 0.7573669 +1 0 0 0
H 2.97697191 +1 -1.0451187 +1 1.7995578 +1 0 0 0
H 4.44542524 +1 -1.1511968 +1 0.7494614 +1 0 0 0
C 3.34459837 +1 1.2487503 +1 0.5161216 +1 0 0 0
H 4.45048994 +1 1.2794163 +1 0.4898056 +1 0 0 0
H 2.99246560 +1 1.3786459 +1 1.5566055 +1 0 0 0
C 2.73718519 +1 2.2869822 +1 -0.4291629 +1 0 0 0
H 3.24587917 +1 3.2648612 +1 -0.3322028 +1 0 0 0
H 2.76351517 +1 1.9537874 +1 -1.4839629 +1 0 0 0
C 0.65768961 +1 3.4137760 +1 -0.7144299 +1 0 0 0
H 0.55182690 +1 3.1062609 +1 -1.7720840 +1 0 0 0
H 1.20401223 +1 4.3745069 +1 -0.6593874 +1 0 0 0
C -0.69408921 +1 3.5077057 +1 -0.0033854 +1 0 0 0
H -0.59557409 +1 3.3755782 +1 1.0904396 +1 0 0 0
H -1.19430830 +1 4.4716247 +1 -0.2165792 +1 0 0 0
C -2.76767428 +1 2.3293046 +1 0.0193812 +1 0 0 0
H -3.34246533 +1 3.2515788 +1 -0.1886419 +1 0 0 0
H -2.68533596 +1 2.1816260 +1 1.1124854 +1 0 0 0
C -3.38734116 +1 1.1152350 +1 -0.6760341 +1 0 0 0
H -4.49244129 +1 1.1458963 +1 -0.6316981 +1 0 0 0
H -3.05936685 +1 1.0327206 +1 -1.7292382 +1 0 0 0
C -3.35389336 +1 -1.2588526 +1 -0.4567165 +1 0 0 0
H -3.00052672 +1 -1.3716472 +1 -1.4989664 +1 0 0 0
H -4.45930854 +1 -1.3008706 +1 -0.4331391 +1 0 0 0
C -2.73634314 +1 -2.3062079 +1 0.4724916 +1 0 0 0
H -2.66300256 +1 -1.9410132 +1 1.5140444 +1 0 0 0
H -3.30934562 +1 -3.2524121 +1 0.4503520 +1 0 0 0
C -0.67487403 +1 -3.4842690 +1 0.6942905 +1 0 0 0
H -1.18665265 +1 -4.4646344 +1 0.6579099 +1 0 0 0
H -0.58485535 +1 -3.1508219 +1 1.7452148 +1 0 0 0
C 0.68615805 +1 -3.5398813 +1 -0.0040194 +1 0 0 0
H 1.20485475 +1 -4.4952448 +1 0.2021720 +1 0 0 0
H 0.59663405 +1 -3.3951938 +1 -1.0968625 +1 0 0 0