Wooldridgeite Cooper M A, Hawthorne F C The Canadian Mineralogist 37 (1999) 73-81 The crystal structure of wooldridgeite, Na2CaCu2(P2O7)2(H2O)10, a novel copper pyrophosphate mineral _database_code_amcsd 0005593 11.938 32.854 11.017 90 90 90 Fdd2 atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Ca 0 0 0 .015 .015 .017 .014 .003 0 0 Na .2143 .0974 .0959 .049 .064 .062 .022 -.034 .017 -.007 Cu .1201 .13964 .6000 .019 .020 .021 .017 .010 .007 .009 P1 .0457 .1811 .3560 .018 .020 .021 .015 -.004 .004 .000 P2 .1413 .0705 .8009 .017 .018 .018 .017 .000 .003 .003 O1 .1986 .0470 .685 .018 .017 .023 .013 .000 -.003 -.002 O2 .0870 .2128 .268 .021 .019 .026 .018 -.006 -.001 .006 O3 .1374 .1687 .445 .027 .024 .039 .019 .014 .005 .006 O4 .2401 .1045 .544 .031 .034 .035 .025 .023 .017 .016 O5 .0916 .1096 .751 .027 .036 .022 .022 .008 .017 .011 O6 .2355 .0781 .893 .028 .027 .035 .022 -.009 -.002 -.008 O7 .0555 .0412 .847 .022 .025 .025 .017 -.012 .003 -.001 Wat1 .0840 .0437 .158 .024 .019 .027 .025 -.002 .003 -.004 Wat2 .042 .1388 .046 .050 .061 .054 .036 -.008 .011 -.004 Wat3 .129 .2119 .924 .044 .042 .045 .045 .003 -.006 -.014 Wat4 .230 .1869 .710 .072 .059 .108 .049 -.046 .020 -.029 Wat5 .1562 .0125 .376 .035 .028 .038 .038 -.002 -.010 -.004