Gottardiite Alberti A, Vezzalini G, Galli E, Quartieri S European Journal of Mineralogy 8 (1996) 69-75 The crystal structure of gottardiite, a new natural zeolite Note: occupancies altered to match chemical formula _database_code_amcsd 0006612 13.698 25.213 22.660 90 90 90 Cmca atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) SiT1 0 .0804 .1973 .861 1.18 .013 .013 .019 0 0 -.002 AlT1 0 .0804 .1973 .138 1.18 .013 .013 .019 0 0 -.002 FeT1 0 .0804 .1973 .001 1.18 .013 .013 .019 0 0 -.002 SiT2 0 .1784 .2828 .861 1.47 .014 .021 .021 0 0 -.004 AlT2 0 .1784 .2828 .138 1.47 .014 .021 .021 0 0 -.004 FeT2 0 .1784 .2828 .001 1.47 .014 .021 .021 0 0 -.004 SiT3 0 .2884 .2204 .861 1.39 .021 .015 .017 0 0 -.003 AlT3 0 .2884 .2204 .138 1.39 .021 .015 .017 0 0 -.003 FeT3 0 .2884 .2204 .001 1.39 .021 .015 .017 0 0 -.003 SiT4 0 .3841 .3023 .861 1.34 .012 .022 .017 0 0 -.007 AlT4 0 .3841 .3023 .138 1.34 .012 .022 .017 0 0 -.007 FeT4 0 .3841 .3023 .001 1.34 .012 .022 .017 0 0 -.007 SiT5 0 .4818 .2235 .861 1.68 .030 .019 .015 0 0 .004 AlT5 0 .4818 .2235 .138 1.68 .030 .019 .015 0 0 .004 FeT5 0 .4818 .2235 .001 1.68 .030 .019 .015 0 0 .004 SiT6 .2102 .0023 .3160 .861 1.95 .020 .030 .024 .004 -.005 .001 AlT6 .2102 .0023 .3160 .138 1.95 .020 .030 .024 .004 -.005 .001 FeT6 .2102 .0023 .3160 .001 1.95 .020 .030 .024 .004 -.005 .001 SiT7 .1934 .0978 .1253 .861 1.34 .014 .019 .018 -.005 .006 -.003 AlT7 .1934 .0978 .1253 .138 1.34 .014 .019 .018 -.005 .006 -.003 FeT7 .1934 .0978 .1253 .001 1.34 .014 .019 .018 -.005 .006 -.003 SiT8 .2122 .1948 .3174 .861 1.11 .011 .014 .017 .001 -.004 .001 AlT8 .2122 .1948 .3174 .138 1.11 .011 .014 .017 .001 -.004 .001 FeT8 .2122 .1948 .3174 .001 1.11 .011 .014 .017 .001 -.004 .001 SiT9 .2143 .3111 .1846 .861 1.32 .018 .012 .020 -.005 .001 .001 AlT9 .2143 .3111 .1846 .138 1.32 .018 .012 .020 -.005 .001 .001 FeT9 .2143 .3111 .1846 .001 1.32 .018 .012 .020 -.005 .001 .001 SiT10 .1873 .4049 .3752 .861 1.18 .015 .015 .015 .002 .004 -.004 AlT10 .1873 .4049 .3752 .138 1.18 .015 .015 .015 .002 .004 -.004 FeT10 .1873 .4049 .3752 .001 1.18 .015 .015 .015 .002 .004 -.004 SiT11 .1151 .0634 .0009 .861 1.53 .025 .019 .014 -.007 .005 -.004 AlT11 .1151 .0634 .0009 .138 1.53 .025 .019 .014 -.007 .005 -.004 FeT11 .1151 .0634 .0009 .001 1.53 .025 .019 .014 -.007 .005 -.004 O1 0 .0208 .2214 3.92 .088 .015 .046 0 0 -.004 O2 .0969 .0897 .1594 .84 .025 .084 .113 .002 .049 .009 O3 0 .1213 .2499 .76 .075 .041 .027 0 0 -.015 O4 .0955 .1833 .3238 .63 .020 .059 .021 -.001 .001 -.012 O5 0 .2249 .2361 3.11 .046 .012 .060 0 0 -.014 O6 .0928 .3040 .1810 2.87 .017 .054 .038 -.008 .007 .010 O7 0 .3225 .2802 2.53 .055 .017 .024 0 0 -.003 O8 .0840 .3950 .3443 6.37 .050 .110 .082 -.001 -.044 -.041 O9 0 .4225 .2462 6.55 .205 .008 .036 0 0 -.016 O10 .0928 .4920 .1818 3.74 .033 .076 .033 .003 .010 -.006 O11 .2280 .1576 .1350 2.66 .027 .038 .036 -.002 -.007 -.006 O12 .2242 .0598 .3504 3.61 .042 .027 .068 -.003 -.009 .005 O13 .2381 .4586 .3559 5.90 .094 .032 .098 -.012 .073 .014 O14 .1754 .0893 .0555 3.00 .026 .079 .009 -.010 -.001 -.014 O15 .2329 .2564 .3357 3.16 .055 .028 .037 -.015 .003 -.004 O16 .25 .1829 .25 2.03 .037 .031 .009 0 .004 0 O17 .2381 .3553 .1332 2.79 .049 .036 .021 -.031 -.016 .012 O18 .25 .3290 .25 1.89 .029 .017 .026 0 .003 0 O19 .25 .0050 .25 5.66 .033 .146 .036 0 .003 0 O20 0 .0807 .0048 2.82 .036 .029 .042 0 0 -.003 O21 .1276 0 0 3.26 .033 .021 .070 0 0 -.005 O22 .1627 .4084 .4406 5.34 .102 .058 .043 .050 .025 .004 NaX1 0 .386 .999 .0186 1.7 KX1 0 .386 .999 .0013 1.7 MgX1 0 .386 .999 .023 1.7 CaX1 0 .386 .999 .0356 1.7 WatX1 0 .386 .999 .6824 1.7 NaX2 0 .183 .430 .0186 4.6 KX2 0 .183 .430 .0013 4.6 MgX2 0 .183 .430 .023 4.6 CaX2 0 .183 .430 .0356 4.6 WatX2 0 .183 .430 .6824 4.6 NaX3 0 .263 .996 .0186 3.9 KX3 0 .263 .996 .0013 3.9 MgX3 0 .263 .996 .023 3.9 CaX3 0 .263 .996 .0356 3.9 WatX3 0 .263 .996 .6824 3.9 NaX4 0 .081 .404 .0186 6.5 KX4 0 .081 .404 .0013 6.5 MgX4 0 .081 .404 .023 6.5 CaX4 0 .081 .404 .0356 6.5 WatX4 0 .081 .404 .6824 6.5 NaX5 .067 .281 .421 .0186 9.1 KX5 .067 .281 .421 .0013 9.1 MgX5 .067 .281 .421 .023 9.1 CaX5 .067 .281 .421 .0356 9.1 WatX5 .067 .281 .421 .6824 9.1 NaX6 .121 .458 .019 .0186 3.9 KX6 .121 .458 .019 .0013 3.9 MgX6 .121 .458 .019 .023 3.9 CaX6 .121 .458 .019 .0356 3.9 WatX6 .121 .458 .019 .6824 3.9 NaX7 0 .192 .071 .0186 11.0 KX7 0 .192 .071 .0013 11.0 MgX7 0 .192 .071 .023 11.0 CaX7 0 .192 .071 .0356 11.0 WatX7 0 .192 .071 .6824 11.0 NaX8 .151 .349 .994 .0186 6.6 KX8 .151 .349 .994 .0013 6.6 MgX8 .151 .349 .994 .023 6.6 CaX8 .151 .349 .994 .0356 6.6 WatX8 .151 .349 .994 .6824 6.6 NaX9 0 .390 .103 .0186 8.9 KX9 0 .390 .103 .0013 8.9 MgX9 0 .390 .103 .023 8.9 CaX9 0 .390 .103 .0356 8.9 WatX9 0 .390 .103 .6824 8.9 NaX10 .120 .268 .558 .0186 9.4 KX10 .120 .268 .558 .0013 9.4 MgX10 .120 .268 .558 .023 9.4 CaX10 .120 .268 .558 .0356 9.4 WatX10 .120 .268 .558 .6824 9.4 NaX11 .193 .271 .473 .0186 12.3 KX11 .193 .271 .473 .0013 12.3 MgX11 .193 .271 .473 .023 12.3 CaX11 .193 .271 .473 .0356 12.3 WatX11 .193 .271 .473 .6824 12.3 NaX12 0 .301 .064 .0186 8.9 KX12 0 .301 .064 .0013 8.9 MgX12 0 .301 .064 .023 8.9 CaX12 0 .301 .064 .0356 8.9 WatX12 0 .301 .064 .6824 8.9