Lithiophilite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R100096 Losey A, Rakovan J F, Hughes J M, Francis C A, Dyar M D The Canadian Mineralogist 42 (2004) 1105-1115 Structural variation in the lithiophilite-triphylite series and other olivine-group structures Note: sample Trip06 Locality: Bennett Quarry, Buckfield, Maine _database_code_amcsd 0005976 CELL PARAMETERS: 4.7460 10.4550 6.1080 90.000 90.000 90.000 SPACE GROUP: Pbnm ATOM X Y Z OCCUPANCY ISO(B) Li 0.00000 0.00000 0.00000 1.000 1.700 Mn 0.97154 0.28163 0.25000 0.933 0.580 Fe 0.97154 0.28163 0.25000 0.062 0.580 P 0.40910 0.09238 0.25000 1.000 0.520 O 0.73100 0.09660 0.25000 1.000 0.850 O 0.21150 0.45580 0.25000 1.000 0.780 O 0.27700 0.16170 0.04940 1.000 0.790 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 4 +/- 9 +/- 5 MAX. ABS. INTENSITY / VOLUME**2: 14.64193255 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 16.96 26.21 5.2275 0 2 0 20.55 60.37 4.3216 1 1 0 22.39 21.21 3.9716 0 2 1 23.74 9.21 3.7477 1 0 1 25.24 73.16 3.5279 1 1 1 25.35 16.09 3.5139 1 2 0 29.24 67.47 3.0540 0 0 2 29.32 13.00 3.0458 1 2 1 31.86 25.90 2.8090 1 3 0 34.00 1.69 2.6370 0 2 2 35.16 100.00 2.5521 1 3 1 36.01 30.79 2.4941 1 1 2 37.42 21.43 2.4030 0 4 1 38.92 11.56 2.3141 2 1 0 39.08 11.06 2.3051 1 2 2 39.35 14.47 2.2895 1 4 0 41.74 7.45 2.1640 2 1 1 41.80 10.81 2.1608 2 2 0 43.79 6.01 2.0675 1 3 2 44.47 5.45 2.0371 2 2 1 45.69 2.59 1.9858 0 4 2 47.52 1.18 1.9135 1 5 0 48.59 11.29 1.8738 2 0 2 48.66 1.11 1.8711 1 0 3 49.41 3.88 1.8444 2 1 2 49.49 13.03 1.8418 1 1 3 49.95 5.53 1.8260 1 5 1 51.83 32.36 1.7639 2 2 2 51.90 6.40 1.7616 1 2 3 52.05 8.62 1.7569 2 4 0 52.52 1.28 1.7425 0 6 0 54.33 15.50 1.6885 2 4 1 54.78 17.55 1.6756 0 6 1 55.76 22.28 1.6485 1 3 3 56.77 2.35 1.6215 1 5 2 57.37 12.25 1.6062 0 4 3 60.57 1.29 1.5286 2 1 3 60.64 13.89 1.5270 0 0 4 60.97 4.95 1.5195 2 5 1 61.16 9.33 1.5153 3 1 1 61.21 2.04 1.5142 3 2 0 61.24 13.20 1.5135 0 6 2 63.28 4.15 1.4697 3 2 1 64.75 2.99 1.4398 1 1 4 65.52 6.99 1.4247 1 7 0 66.58 1.86 1.4045 2 6 0 66.71 3.29 1.4021 3 3 1 67.13 1.28 1.3944 1 5 3 68.56 2.56 1.3688 2 6 1 69.26 11.21 1.3566 3 2 2 69.45 1.45 1.3534 3 4 0 70.15 3.19 1.3416 1 3 4 70.84 2.21 1.3301 2 4 3 71.23 5.76 1.3239 0 6 3 71.38 4.90 1.3214 3 4 1 72.56 2.34 1.3029 3 3 2 73.32 8.47 1.2911 1 7 2 73.79 1.31 1.2841 2 0 4 74.44 1.94 1.2745 2 1 4 75.33 1.17 1.2616 3 5 0 76.37 3.52 1.2470 2 2 4 76.68 2.84 1.2427 2 5 3 76.85 2.54 1.2404 3 1 3 78.77 1.05 1.2150 3 2 3 81.04 1.17 1.1865 4 0 0 81.67 1.10 1.1789 4 1 0 81.93 1.71 1.1760 3 3 3 81.96 1.46 1.1755 1 1 5 82.61 1.45 1.1680 2 7 2 82.77 3.56 1.1660 3 5 2 82.89 2.26 1.1647 1 8 2 83.64 1.84 1.1561 2 6 3 83.96 1.78 1.1525 2 4 4 84.16 1.43 1.1503 3 6 1 84.33 1.47 1.1484 0 6 4 86.19 1.73 1.1284 1 9 0 86.31 4.37 1.1271 3 4 3 86.50 2.70 1.1252 2 8 1 86.97 5.38 1.1203 1 3 5 89.01 4.12 1.0998 4 1 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.