data_global _chemical_name_mineral 'Sterryite' loop_ _publ_author_name 'Moelo Y' 'Guillot-Deudon C' 'Evain M' 'Orlandi P' 'Biagioni C' _journal_name_full 'Acta Crystallographica, Section B' _journal_volume 68 _journal_year 2012 _journal_page_first 480 _journal_page_last 492 _publ_section_title ; Comparative modular analysis of two complex sulfosalt structures: sterryite, Cu(Ag,Cu)3Pb19-(Sb,As)22(As-As)S56, and parasterryite, Ag4Pb20(Sb,As)24S58 ; _database_code_amcsd 0019482 _chemical_compound_source 'Pollone mine, Tuscany, Italy' _chemical_formula_sum 'Pb19.13 Bi.1 Sb16.47 As7.06 Tl.24 Ag1.86 Cu1.73 Hg.24 S56' _cell_length_a 8.1891 _cell_length_b 28.5294 _cell_length_c 42.98 _cell_angle_alpha 90 _cell_angle_beta 94.896 _cell_angle_gamma 90 _cell_volume 10004.783 _exptl_crystal_density_diffrn 5.791 _symmetry_space_group_name_H-M 'P 1 21/n 1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2-y,1/2+z' '1/2-x,1/2+y,1/2-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Pb1 0.72690 0.63980 0.19903 1.00000 0.02360 Pb2 0.22040 0.63585 0.19887 1.00000 0.02280 Pb3 0.68060 0.69994 0.10114 1.00000 0.02660 Pb4 0.17960 0.69914 0.10211 1.00000 0.02390 Pb5 0.68270 0.54811 0.11574 1.00000 0.02480 Pb6 0.18800 0.54785 0.11636 1.00000 0.02570 Pb7 0.67850 0.40767 0.10849 0.90000 0.02150 Bi7 0.67850 0.40767 0.10849 0.10000 0.02150 Pb8 0.18960 0.40343 0.11030 1.00000 0.02390 Sb9 0.53050 0.01042 0.29831 1.00000 0.02160 Sb10 0.47060 0.49980 0.19294 0.70000 0.01820 As10 0.47060 0.49980 0.19294 0.30000 0.01820 Sb11 0.49510 0.08142 0.22572 0.91000 0.01910 As11 0.49510 0.08142 0.22572 0.09000 0.01910 Sb12 -0.00040 0.09558 0.21938 0.50000 0.01770 As12 -0.00040 0.09558 0.21938 0.50000 0.01770 Pb13 0.73550 0.21623 0.21405 1.00000 0.02580 Pb14 0.23370 0.21029 0.20834 0.76000 0.02820 Tl14 0.23370 0.21029 0.20834 0.24000 0.02820 Sb15 0.95570 0.76196 0.17837 0.07000 0.01540 As15 0.95570 0.76196 0.17837 0.93000 0.01540 Sb16 0.43420 0.76744 0.17674 0.86000 0.02290 As16 0.43420 0.76744 0.17674 0.14000 0.02290 Sb17 0.90150 0.83817 0.09471 1.00000 0.02240 Sb18 0.42940 0.82664 0.09887 0.45000 0.02310 As18 0.42940 0.82664 0.09887 0.55000 0.02310 Sb19 0.89840 0.90892 0.02117 0.82000 0.02610 As19 0.89840 0.90892 0.02117 0.18000 0.02610 Sb20 0.37960 0.92081 0.01144 0.80000 0.02270 As20 0.37960 0.92081 0.01144 0.20000 0.02270 Sb21 0.33800 0.49779 0.42995 1.00000 0.02800 Pb22 0.85260 0.49900 0.43845 0.67000 0.03670 Sb22 0.85260 0.49900 0.43845 0.33000 0.03670 Pb23 0.18040 0.91576 0.14472 0.83000 0.02980 Sb23 0.18040 0.91576 0.14472 0.17000 0.02980 Sb24 0.70480 0.91749 0.15226 1.00000 0.02180 Ag25 0.23430 0.82810 0.23710 0.90000 0.04800 Cu25 0.23430 0.82810 0.23710 0.10000 0.04800 Sb26 0.73300 0.83424 0.23460 0.85000 0.02410 As26 0.73300 0.83424 0.23460 0.15000 0.02410 Pb27 0.00420 0.38059 0.19626 1.00000 0.02820 Sb28 0.47920 0.36806 0.19252 0.55000 0.02620 As28 0.47920 0.36806 0.19252 0.45000 0.02620 Sb29 0.45750 0.95474 0.22192 1.00000 0.03310 Pb30 0.52180 0.46856 0.27371 1.00000 0.03210 Pb31 0.43850 0.04969 0.14240 1.00000 0.03010 Pb32 0.93440 0.05142 0.14031 1.00000 0.03300 Ag33b 0.35500 0.12160 0.05480 0.60000 0.02100 Cu33a 0.38500 0.11250 0.06030 0.40000 0.02100 Ag34b 0.91740 0.11888 0.05761 0.36000 0.04620 Hg34b 0.91740 0.11888 0.05761 0.24000 0.04620 Cu34b 0.91740 0.11888 0.05761 0.40000 0.04620 Pb35 0.64320 0.78361 0.01656 1.00000 0.02710 Pb36 0.13760 0.78670 0.01835 1.00000 0.02900 Sb37 0.89700 0.62016 0.03928 0.27000 0.01830 As37 0.89700 0.62016 0.03928 0.73000 0.01830 Sb38 0.39300 0.61302 0.03657 1.00000 0.02200 Sb39 0.89610 0.46983 0.03944 1.00000 0.02190 Sb40 0.39940 0.48411 0.04011 0.36000 0.01740 As40 0.39940 0.48411 0.04011 0.64000 0.01740 Pb41 0.90480 0.33727 0.03897 0.14000 0.02200 Sb41 0.90480 0.33727 0.03897 0.86000 0.02200 Sb42 0.38700 0.32966 0.03506 0.80000 0.02030 As42 0.38700 0.32966 0.03506 0.20000 0.02030 Cu43 0.64650 0.21330 0.05820 0.83000 0.04100 Pb44a 0.67920 0.27434 0.11949 0.83000 0.02740 Sb44b 0.67920 0.27434 0.11949 0.17000 0.02740 Pb45 0.18490 0.25801 0.10565 1.00000 0.03210 As46 0.85870 0.16461 0.13154 1.00000 0.01770 As47 0.53860 0.15950 0.13276 1.00000 0.02070 S1 0.95310 0.69100 0.15410 1.00000 0.01300 S2 0.44450 0.69130 0.15570 1.00000 0.01200 S3 0.92610 0.62290 0.09340 1.00000 0.01700 S4 0.42500 0.62360 0.09280 1.00000 0.01200 S5 0.95760 0.57260 0.16590 1.00000 0.01200 S6 0.45610 0.57220 0.16810 1.00000 0.01500 S7 0.49650 0.15600 0.25050 1.00000 0.01400 S8 0.49110 0.66470 0.24760 1.00000 0.02100 S9 0.91840 0.76320 0.06980 1.00000 0.01900 S10 0.41020 0.76060 0.06570 1.00000 0.02000 S11 0.92900 0.47860 0.09710 1.00000 0.02100 S12 0.41900 0.47670 0.09580 1.00000 0.02300 S13 0.68600 0.47360 0.16380 1.00000 0.01700 S14 0.22690 0.47220 0.16450 1.00000 0.02100 S15 0.77360 0.55100 0.23750 1.00000 0.02000 S16 0.21220 0.54900 0.23690 1.00000 0.01900 S17 -0.24230 0.11710 0.19020 1.00000 0.01800 S18 0.19400 0.12280 0.18450 1.00000 0.03100 S19 0.77110 0.74140 0.21290 1.00000 0.02000 S20 0.19660 0.75200 0.21090 1.00000 0.01500 S21 0.66110 0.80360 0.13140 1.00000 0.02200 S22 0.23740 0.79880 0.13430 1.00000 0.01600 S23 0.68610 0.87150 0.05730 1.00000 0.02200 S24 1.12700 0.87370 0.05470 1.00000 0.02700 S25 0.41280 0.04760 0.02360 1.00000 0.01900 S26 0.86420 0.04850 0.02030 1.00000 0.02100 S27 0.09580 0.46830 0.39640 1.00000 0.02000 S28 0.94600 0.96780 0.10420 1.00000 0.02800 S29 0.48550 0.88800 0.18470 1.00000 0.00700 S30 0.94450 0.88930 0.18600 1.00000 0.02100 S31 0.52900 0.80200 0.26660 1.00000 0.02300 S32 0.52370 0.30870 0.23070 1.00000 0.01600 S33 0.25170 0.32880 0.16750 1.00000 0.02500 S34 0.69940 0.34600 0.16350 1.00000 0.01900 S35 0.24150 0.41000 0.24910 1.00000 0.02000 S36 0.77110 0.41640 0.24140 1.00000 0.02100 S37 0.28500 0.49220 0.32060 1.00000 0.02200 S38 0.70900 0.99420 0.17560 1.00000 0.01300 S39 0.16960 0.07430 0.09590 1.00000 0.01600 S40 0.82110 0.57420 0.40300 1.00000 0.01500 S41 0.13100 0.15560 0.01450 1.00000 0.02500 S42 0.62310 0.15730 0.01000 1.00000 0.02000 S43 0.69000 0.67690 0.03460 1.00000 0.02900 S44 0.11200 0.67020 0.03110 1.00000 0.02800 S45 0.61300 0.53960 0.03900 1.00000 0.02500 S46 0.18710 0.54500 0.03900 1.00000 0.01700 S47 0.68140 0.41060 0.03930 1.00000 0.01400 S48 0.11600 0.40650 0.04060 1.00000 0.01800 S49 0.61000 0.27660 0.02550 1.00000 0.03300 S50 0.17200 0.27280 0.03800 1.00000 0.02400 S51 0.89510 0.19680 0.08390 1.00000 0.01900 S52 0.43910 0.18990 0.08680 1.00000 0.01900 S53 0.93680 0.22760 0.16130 1.00000 0.00700 S54 0.48120 0.22370 0.16290 1.00000 0.01700 S55 0.92960 0.33490 0.09930 1.00000 0.01900 S56 0.42310 0.33380 0.09320 1.00000 0.01400 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Pb1 0.01190 0.02140 0.03840 -0.00180 0.00780 -0.00280 Pb2 0.01100 0.02300 0.03520 0.00050 0.00640 -0.00050 Pb3 0.01130 0.03310 0.03600 0.00130 0.00580 0.00200 Pb4 0.01010 0.02320 0.03940 -0.00100 0.00730 0.00070 Pb5 0.01040 0.01530 0.04980 -0.00160 0.00810 -0.00340 Pb6 0.00880 0.02150 0.04780 0.00250 0.00850 -0.00210 Pb7 0.00490 0.02190 0.03850 0.00350 0.00560 -0.00180 Bi7 0.00490 0.02190 0.03850 0.00350 0.00560 -0.00180 Pb8 0.00720 0.02260 0.04260 -0.00040 0.00690 -0.00300 Sb9 0.02700 0.00490 0.03400 0.00620 0.01000 -0.00040 Sb10 0.01500 0.00390 0.03700 -0.00670 0.00700 -0.00050 As10 0.01500 0.00390 0.03700 -0.00670 0.00700 -0.00050 Sb11 0.01350 0.01540 0.02800 0.00040 0.00190 -0.00390 As11 0.01350 0.01540 0.02800 0.00040 0.00190 -0.00390 Sb12 0.00760 0.01020 0.03600 -0.00180 0.00700 0.00180 As12 0.00760 0.01020 0.03600 -0.00180 0.00700 0.00180 Pb13 0.00870 0.02740 0.04200 0.00250 0.00580 -0.00030 Pb14 0.01530 0.01540 0.05590 -0.00130 0.01390 -0.00200 Tl14 0.01530 0.01540 0.05590 -0.00130 0.01390 -0.00200 Sb15 0.01000 0.01200 0.02500 -0.00100 0.00700 0.00200 As15 0.01000 0.01200 0.02500 -0.00100 0.00700 0.00200 Sb16 0.02100 0.01610 0.03200 -0.00050 0.00600 -0.00070 As16 0.02100 0.01610 0.03200 -0.00050 0.00600 -0.00070 Sb17 0.01560 0.00720 0.04400 0.00190 0.00000 -0.00640 Sb18 0.00180 0.03200 0.03600 0.00000 0.00400 -0.00300 As18 0.00180 0.03200 0.03600 0.00000 0.00400 -0.00300 Sb19 0.01500 0.01860 0.04400 -0.00070 0.00100 -0.00700 As19 0.01500 0.01860 0.04400 -0.00070 0.00100 -0.00700 Sb20 0.00940 0.01720 0.04100 -0.00430 0.00200 0.00160 As20 0.00940 0.01720 0.04100 -0.00430 0.00200 0.00160 Sb21 0.00390 0.01790 0.06300 -0.00080 0.01000 -0.00600 Pb22 0.01330 0.05560 0.04150 0.00320 0.00340 0.00240 Sb22 0.01330 0.05560 0.04150 0.00320 0.00340 0.00240 Pb23 0.00980 0.03760 0.04200 -0.00340 0.00280 0.00090 Sb23 0.00980 0.03760 0.04200 -0.00340 0.00280 0.00090 Sb24 0.01040 0.01010 0.04600 -0.00170 0.00850 -0.00030 Ag25 0.04200 0.03000 0.07400 -0.00600 0.01900 -0.02300 Cu25 0.04200 0.03000 0.07400 -0.00600 0.01900 -0.02300 Sb26 0.01230 0.02600 0.03500 0.00440 0.00900 0.00200 As26 0.01230 0.02600 0.03500 0.00440 0.00900 0.00200 Pb27 0.02270 0.02200 0.04120 0.00210 0.00940 0.00090 Sb28 0.01300 0.03500 0.03100 0.00700 0.00700 0.00600 As28 0.01300 0.03500 0.03100 0.00700 0.00700 0.00600 Sb29 0.03000 0.04000 0.03200 -0.01400 0.01500 -0.00600 Pb30 0.02350 0.02350 0.04970 -0.00020 0.00540 -0.00330 Pb31 0.01960 0.02740 0.04390 -0.00360 0.00620 0.00090 Pb32 0.01780 0.02520 0.05730 0.00040 0.00960 0.00530 Ag33b 0.04100 0.00500 0.01700 0.00200 -0.00600 0.00200 Cu33a 0.04100 0.00500 0.01700 0.00200 -0.00600 0.00200 Ag34b 0.06800 0.02600 0.04500 0.01400 0.00700 -0.00700 Hg34b 0.06800 0.02600 0.04500 0.01400 0.00700 -0.00700 Cu34b 0.06800 0.02600 0.04500 0.01400 0.00700 -0.00700 Pb35 0.01240 0.03000 0.03950 -0.00220 0.00570 0.00230 Pb36 0.01530 0.02970 0.04240 0.00320 0.00580 0.00300 Sb37 0.01300 0.01300 0.03000 -0.00300 0.00700 0.00400 As37 0.01300 0.01300 0.03000 -0.00300 0.00700 0.00400 Sb38 0.01900 0.02300 0.02400 0.00110 0.00460 0.00030 Sb39 0.00820 0.02330 0.03500 -0.00440 0.00460 -0.00110 Sb40 0.00700 0.01400 0.03200 -0.00280 0.00800 0.00200 As40 0.00700 0.01400 0.03200 -0.00280 0.00800 0.00200 Pb41 0.01000 0.02190 0.03500 0.00150 0.00770 -0.00080 Sb41 0.01000 0.02190 0.03500 0.00150 0.00770 -0.00080 Sb42 0.00480 0.01880 0.03800 0.00170 0.00630 -0.00170 As42 0.00480 0.01880 0.03800 0.00170 0.00630 -0.00170 Cu43 0.00700 0.08200 0.03500 0.00300 0.00600 0.03000 Pb44a 0.00810 0.01930 0.05600 0.00280 0.00880 0.00720 Sb44b 0.00810 0.01930 0.05600 0.00280 0.00880 0.00720 Pb45 0.01320 0.02720 0.05720 0.00260 0.01050 0.00780 As46 0.00400 0.00000 0.05000 0.00150 0.00900 -0.00300 As47 0.00600 0.02800 0.02900 -0.00100 0.00700 0.00400