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. 2012 Sep 26;68(Pt 10):m1303–m1304. doi: 10.1107/S1600536812036641
x y z Uiso*/Ueq
Cu1 0.53009 (2) 0.529307 (15) 0.136932 (15) 0.00981 (7)
K1 0.10262 (4) 0.38634 (3) −0.06404 (3) 0.01425 (9)
K2 0.86027 (5) 0.61378 (3) 0.38164 (3) 0.01645 (9)
O1 0.86577 (14) 0.45133 (10) 0.22512 (10) 0.0138 (2)
O1A 0.20044 (14) 0.60207 (10) 0.03346 (10) 0.0151 (2)
O2 0.41091 (14) 0.39928 (10) 0.08061 (10) 0.0139 (2)
O2A 0.65548 (14) 0.66325 (10) 0.16771 (9) 0.0117 (2)
O3 0.43256 (15) 0.22059 (10) 0.09720 (10) 0.0160 (3)
O3A 0.61938 (14) 0.84124 (10) 0.16679 (10) 0.0140 (2)
O1W 0.52488 (16) 0.52800 (10) 0.30436 (10) 0.0160 (3)
H11W 0.4781 (7) 0.4699 (8) 0.3201 (2) 0.024*
H21W 0.5029 (3) 0.5835 (8) 0.3278 (3) 0.024*
O2W 0.10231 (16) 0.33982 (12) 0.13939 (11) 0.0205 (3)
H12W 0.0333 (11) 0.3648 (4) 0.1612 (4) 0.031*
H22W 0.1900 (14) 0.3541 (3) 0.1987 (10) 0.031*
O3W 0.89136 (15) 0.65821 (11) 0.59001 (11) 0.0194 (3)
H13W 0.8132 (13) 0.6471 (2) 0.6103 (4) 0.029*
H23W 0.9754 (14) 0.6349 (4) 0.6428 (9) 0.029*
N1 0.71631 (17) 0.42739 (12) 0.18069 (11) 0.0111 (3)
N1A 0.34617 (17) 0.62774 (12) 0.07855 (11) 0.0113 (3)
N2 0.86325 (19) 0.16875 (13) 0.23004 (13) 0.0203 (3)
N2A 0.19141 (19) 0.88673 (13) 0.03683 (13) 0.0186 (3)
C1 0.7741 (2) 0.23825 (14) 0.20181 (13) 0.0125 (3)
C1A 0.2811 (2) 0.81670 (14) 0.06281 (13) 0.0128 (3)
C2 0.66627 (19) 0.32726 (14) 0.16742 (13) 0.0111 (3)
C2A 0.3926 (2) 0.72992 (14) 0.09515 (13) 0.0114 (3)
C3 0.4904 (2) 0.31178 (13) 0.11168 (13) 0.0114 (3)
C3A 0.5671 (2) 0.74813 (14) 0.14657 (13) 0.0109 (3)