Kryzhanovskite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R130691 Moore P B, Araki T, Kampf A R Mineralogical Magazine 43 (1980) 789-795 Nomenclature of the phosphoferrite structure type: refinements of landesite and kryzhanovskite Locality: co-type sample from Ak-Kezen pegmatite, Belogorskii, Eastern Kazakhstan _database_code_amcsd 0014473 CELL PARAMETERS: 9.4570 9.9060 8.1920 90.000 90.000 90.000 SPACE GROUP: Pbna ATOM X Y Z OCCUPANCY ISO(B) Mn 0.05105 0.11205 0.63602 0.500 1.400 Fe 0.05105 0.11205 0.63602 0.500 1.400 Fe 0.00000 0.00000 0.00000 1.000 1.160 P 0.20931 0.10344 0.28853 1.000 0.620 O 0.21310 0.25410 0.32910 1.000 0.990 O 0.11190 0.03200 0.41280 1.000 0.970 O 0.36140 0.04460 0.30330 1.000 1.090 O 0.15730 0.08400 0.11480 1.000 1.150 Wa -0.06720 0.25000 0.50000 1.000 1.680 Wa -0.03030 0.33890 0.13580 1.000 1.260 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 8 +/- 9 +/- 7 MAX. ABS. INTENSITY / VOLUME**2: 21.21570128 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 14.30 1.83 6.1919 1 0 1 16.89 15.08 5.2506 1 1 1 17.91 30.23 4.9530 0 2 0 18.77 32.03 4.7285 2 0 0 20.82 16.78 4.2673 2 1 0 21.70 1.14 4.0960 0 0 2 22.99 17.45 3.8678 1 2 1 26.05 6.05 3.4202 2 2 0 28.27 2.27 3.1565 0 2 2 28.28 97.73 3.1561 2 2 1 28.84 30.12 3.0960 2 0 2 29.84 18.12 2.9941 1 2 2 30.25 3.71 2.9550 2 1 2 30.38 2.08 2.9420 3 0 1 30.69 1.75 2.9136 1 3 1 33.09 15.85 2.7072 2 3 0 34.15 4.90 2.6253 2 2 2 34.18 7.84 2.6235 1 0 3 35.39 16.68 2.5361 1 1 3 35.49 2.32 2.5295 3 2 1 36.21 3.93 2.4807 1 3 2 36.27 1.41 2.4765 0 4 0 37.12 8.67 2.4223 3 1 2 37.61 8.77 2.3913 0 2 3 37.96 7.08 2.3705 0 4 1 38.06 3.28 2.3642 4 0 0 38.84 11.81 2.3184 1 2 3 39.17 1.17 2.3001 2 1 3 39.17 1.38 2.2997 4 1 0 39.18 7.15 2.2994 1 4 1 40.75 10.43 2.2141 4 1 1 41.09 10.49 2.1966 3 3 1 42.36 1.53 2.1340 2 2 3 42.66 9.14 2.1193 0 4 2 42.67 1.53 2.1192 2 4 1 43.78 5.80 2.0680 1 4 2 43.85 2.58 2.0648 4 2 1 43.86 2.25 2.0640 3 0 3 44.22 2.06 2.0480 0 0 4 44.86 2.29 2.0206 3 1 3 45.53 9.83 1.9922 3 3 2 46.27 1.52 1.9620 1 1 4 46.99 3.66 1.9339 2 4 2 47.28 2.36 1.9225 2 3 3 47.29 2.42 1.9223 4 3 0 47.74 12.36 1.9052 3 2 3 48.02 6.99 1.8946 3 4 1 48.08 3.80 1.8923 4 2 2 48.44 1.59 1.8793 2 0 4 48.65 1.68 1.8715 4 3 1 49.36 2.38 1.8464 2 1 4 49.46 2.63 1.8429 5 0 1 50.36 2.70 1.8118 5 1 1 52.27 1.47 1.7502 3 3 3 53.02 2.80 1.7272 5 2 1 54.21 1.63 1.6921 3 1 4 54.21 4.77 1.6919 5 1 2 54.59 2.63 1.6813 4 2 3 56.33 1.38 1.6333 2 3 4 56.89 1.18 1.6185 0 6 1 57.05 1.11 1.6144 1 0 5 57.25 3.32 1.6092 5 3 1 57.80 5.98 1.5953 1 6 1 58.48 5.32 1.5782 0 4 4 58.49 2.47 1.5781 4 4 2 59.28 2.61 1.5587 2 6 0 59.37 1.39 1.5566 6 1 0 59.42 3.91 1.5555 0 2 5 59.45 2.37 1.5548 5 0 3 59.55 4.89 1.5523 3 5 2 60.25 4.97 1.5360 5 1 3 60.30 4.72 1.5349 1 2 5 60.46 1.70 1.5313 0 6 2 60.46 3.64 1.5312 2 6 1 60.54 1.33 1.5294 4 1 4 60.80 1.54 1.5235 5 3 2 61.01 1.13 1.5186 2 5 3 61.33 2.29 1.5116 1 6 2 61.99 12.80 1.4971 2 4 4 62.17 7.09 1.4931 4 5 1 62.86 1.38 1.4785 5 4 1 62.90 2.59 1.4776 2 2 5 62.90 2.79 1.4775 4 2 4 63.99 1.48 1.4551 6 1 2 64.05 1.50 1.4538 3 0 5 64.75 3.38 1.4398 3 6 1 64.82 2.06 1.4384 3 1 5 65.64 1.91 1.4224 6 3 0 66.14 1.26 1.4128 0 6 3 66.74 1.73 1.4016 4 3 4 69.31 1.33 1.3557 2 7 0 69.51 2.56 1.3523 6 1 3 70.31 2.36 1.3389 1 1 6 70.67 2.86 1.3330 7 0 1 71.93 1.02 1.3126 4 4 4 72.50 1.10 1.3037 1 2 6 73.59 1.24 1.2871 2 7 2 73.71 1.18 1.2853 4 6 2 74.59 2.07 1.2724 7 1 2 77.01 1.13 1.2383 0 8 0 77.65 1.03 1.2297 5 6 1 81.92 1.36 1.1761 1 8 2 87.02 1.79 1.1198 1 8 3 87.35 1.10 1.1164 1 5 6 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.