Fergusonite-(Y) Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R110050 Komkov A I Soviet Physics - Crystallography 4 (1959) 796-800 The structure of natural fergusonite, and a polymorphic modification Locality: Ural Mountains, Russia _database_code_amcsd 0015538 CELL PARAMETERS: 5.1620 5.1620 10.9250 90.000 90.000 90.000 SPACE GROUP: I4_1/a ATOM X Y Z OCCUPANCY ISO(B) Y 0.00000 0.00000 0.50000 0.850 1.500 Yb 0.00000 0.00000 0.50000 0.150 1.500 Nb 0.00000 0.00000 0.00000 1.000 1.000 O 0.18500 0.25000 0.09200 1.000 1.000 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 4 +/- 4 +/- 10 MAX. ABS. INTENSITY / VOLUME**2: 198.7743622 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 29.43 100.00 3.0349 1 1 2 32.79 10.86 2.7313 0 0 4 34.76 15.89 2.5810 2 0 0 41.28 1.79 2.1868 1 1 4 48.53 30.43 1.8759 2 0 4 49.97 14.57 1.8250 2 2 0 56.48 13.13 1.6294 1 1 6 59.06 10.49 1.5640 3 1 2 59.06 11.95 1.5640 1 3 2 61.07 7.59 1.5174 2 2 4 68.74 1.56 1.3656 0 0 8 73.36 3.25 1.2905 4 0 0 78.73 4.68 1.2154 3 1 6 78.73 3.58 1.2154 1 3 6 79.38 4.15 1.2071 2 0 8 80.95 3.77 1.1876 3 3 2 82.71 3.01 1.1668 4 0 4 83.81 1.45 1.1543 2 4 0 83.81 1.45 1.1543 4 2 0 89.67 2.74 1.0934 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.