Fe2GeS4 Vincent H, Bertaut E Acta Crystallographica B32 (1976) 1749-1755 Polyhedral deformations in olivine-type compounds and the crystal structure of Fe2 Si S4 and Fe2 Ge S4 _cod_database_code 1008007 _database_code_amcsd 0015955 CELL PARAMETERS: 12.4670 7.2130 5.9020 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 530.734 Density (g/cm3): 3.912 MAX. ABS. INTENSITY / VOLUME**2: 20.78249069 RIR: 1.730 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 14.21 13.42 6.2335 2 0 0 2 18.82 43.30 4.7163 2 1 0 4 19.43 17.90 4.5678 0 1 1 4 20.71 16.98 4.2889 1 1 1 8 20.73 11.95 4.2857 2 0 1 4 24.16 7.59 3.6844 2 1 1 8 24.69 17.41 3.6065 0 2 0 2 26.23 38.67 3.3979 3 0 1 4 29.05 96.47 3.0739 3 1 1 8 29.91 100.00 2.9877 1 2 1 8 30.29 1.15 2.9510 0 0 2 2 31.15 6.80 2.8716 1 0 2 4 31.26 19.24 2.8611 4 1 0 4 32.45 35.72 2.7595 2 2 1 8 32.49 21.27 2.7561 4 0 1 4 33.59 25.84 2.6680 1 1 2 8 33.60 1.12 2.6672 2 0 2 4 36.33 3.90 2.4731 3 2 1 8 37.38 10.46 2.4061 3 0 2 4 38.16 5.37 2.3582 4 2 0 4 39.22 10.50 2.2968 5 0 1 4 39.46 2.80 2.2839 0 2 2 4 40.14 7.37 2.2465 1 2 2 8 40.20 3.49 2.2432 2 3 0 4 41.18 2.23 2.1920 1 3 1 8 41.22 2.72 2.1898 4 2 1 8 41.25 2.12 2.1886 5 1 1 8 42.14 70.26 2.1445 2 2 2 8 42.17 27.95 2.1429 4 0 2 4 43.14 2.59 2.0969 2 3 1 8 43.56 1.78 2.0778 6 0 0 2 44.09 12.35 2.0541 4 1 2 8 45.31 11.70 2.0015 3 2 2 8 45.43 6.81 1.9966 6 1 0 4 46.26 25.05 1.9627 3 3 1 8 46.75 1.19 1.9433 1 0 3 4 46.90 2.75 1.9373 5 2 1 8 47.78 7.72 1.9037 4 3 0 4 47.93 3.02 1.8980 0 1 3 4 48.11 1.83 1.8913 6 1 1 8 48.52 3.34 1.8764 1 1 3 8 48.52 3.49 1.8761 2 0 3 4 49.44 8.07 1.8435 1 3 2 8 49.48 1.93 1.8422 4 2 2 8 49.50 10.78 1.8415 5 1 2 8 50.25 1.70 1.8157 2 1 3 8 50.62 37.69 1.8032 0 4 0 2 50.71 65.24 1.8004 6 2 0 4 51.15 1.25 1.7858 2 3 2 8 51.39 5.33 1.7781 3 0 3 4 53.04 7.69 1.7265 3 1 3 8 53.57 7.68 1.7107 1 2 3 8 53.76 13.52 1.7051 7 0 1 4 55.19 32.88 1.6644 2 2 3 8 55.21 14.21 1.6636 4 0 3 4 55.27 1.36 1.6621 2 4 1 8 56.79 3.74 1.6211 4 1 3 8 57.62 3.36 1.5997 4 3 2 8 57.81 1.10 1.5948 3 2 3 8 57.89 6.75 1.5928 3 4 1 8 58.73 2.88 1.5721 6 3 0 4 60.64 1.75 1.5271 1 4 2 8 60.74 1.62 1.5248 7 0 2 4 60.84 2.26 1.5226 0 3 3 4 60.99 1.85 1.5191 6 3 1 8 61.34 1.48 1.5114 1 3 3 8 61.37 2.03 1.5107 4 2 3 8 61.39 1.11 1.5102 5 1 3 8 61.45 4.46 1.5090 4 4 1 8 61.55 1.32 1.5067 8 0 1 4 62.18 5.07 1.4929 5 3 2 8 62.23 2.34 1.4918 7 1 2 8 63.00 6.11 1.4755 0 0 4 2 63.03 1.01 1.4749 8 1 1 8 64.59 3.73 1.4430 3 4 2 8 65.26 3.69 1.4296 3 3 3 8 65.78 3.11 1.4198 5 2 3 8 65.85 3.96 1.4184 5 4 1 8 66.38 1.77 1.4082 2 1 4 8 66.53 1.75 1.4055 2 5 0 4 66.58 2.18 1.4044 7 2 2 8 66.75 2.79 1.4014 6 1 3 8 67.35 1.22 1.3903 8 2 1 8 67.94 10.39 1.3797 4 4 2 8 68.03 5.25 1.3780 8 0 2 4 68.60 2.50 1.3681 4 3 3 8 70.61 2.31 1.3340 2 2 4 8 70.63 1.48 1.3336 4 0 4 4 70.98 5.89 1.3279 3 5 1 8 71.12 2.98 1.3256 9 1 1 8 71.45 2.72 1.3203 7 0 3 4 72.74 1.97 1.3001 2 4 3 8 73.46 2.18 1.2891 1 5 2 8 73.55 1.35 1.2877 7 3 2 8 75.02 2.75 1.2661 3 4 3 8 75.22 5.97 1.2632 9 2 1 8 75.87 1.05 1.2539 9 0 2 4 76.96 7.71 1.2389 7 4 1 8 77.42 1.66 1.2327 2 3 4 8 77.74 1.45 1.2285 10 1 0 4 77.76 1.03 1.2281 6 3 3 8 78.17 8.99 1.2227 4 4 3 8 78.26 5.38 1.2216 8 0 3 4 80.21 2.36 1.1967 4 5 2 8 81.22 1.72 1.1844 9 2 2 8 81.91 1.90 1.1762 9 3 1 8 81.99 2.48 1.1751 1 0 5 4 82.20 3.98 1.1728 1 6 1 8 82.92 1.20 1.1643 7 4 2 8 83.31 3.44 1.1599 1 1 5 8 83.52 1.37 1.1575 2 6 1 8 83.57 1.39 1.1570 8 2 3 8 83.70 1.81 1.1555 10 2 1 8 84.19 1.97 1.1500 5 5 2 8 84.92 4.50 1.1419 0 4 4 4 84.99 7.41 1.1412 6 2 4 8 85.65 2.31 1.1341 10 1 2 8 86.97 1.46 1.1203 3 5 3 8 89.40 5.48 1.0960 2 6 2 8 89.51 4.43 1.0949 8 4 2 8 89.58 1.89 1.0943 10 2 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.