Merrillite
Hughes J M, Jolliff B L, Gunter M E
American Mineralogist 91 (2006) 1547-1552
The atomic arrangement of merrillite from the Fra Mauro Formation, Apollo 14
lunar mission: The first structure of merrillite from the Moon
_database_code_amcsd 0004238
CELL PARAMETERS: 10.2909 10.2909 36.8746 90.000 90.000 120.000
SPACE GROUP: R3c
X-RAY WAVELENGTH: 1.541838
Cell Volume: 3381.930
Density (g/cm3): 3.057
MAX. ABS. INTENSITY / VOLUME**2: 10.31902653
RIR: 1.099
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
11.03 22.76 8.0239 0 1 2 3
13.82 34.27 6.4075 1 0 4 3
14.41 6.08 6.1458 0 0 6 1
17.23 37.13 5.1455 1 1 0 6
18.70 1.11 4.7464 1 1 3 6
20.50 3.31 4.3314 2 0 2 3
21.71 1.44 4.0942 0 1 8 3
22.16 8.92 4.0120 0 2 4 3
22.54 1.90 3.9453 1 1 6 6
26.15 28.53 3.4073 1 0 10 3
26.57 3.64 3.3545 2 1 1 6
26.91 7.25 3.3136 1 2 2 6
27.83 1.44 3.2052 1 1 9 6
28.21 51.55 3.1639 2 1 4 6
30.08 15.33 2.9707 3 0 0 3
31.49 100.00 2.8409 0 2 10 3
32.93 20.37 2.7196 1 2 8 6
33.50 4.23 2.6746 0 3 6 3
33.50 2.78 2.6746 3 0 6 3
33.98 4.11 2.6382 1 1 12 6
34.87 69.44 2.5727 2 2 0 6
35.54 3.64 2.5259 0 1 14 3
35.65 4.56 2.5182 2 2 3 6
36.12 12.96 2.4870 2 1 10 6
36.43 1.12 2.4663 1 3 1 6
37.68 2.13 2.3875 1 3 4 6
37.86 2.11 2.3761 1 2 11 6
37.91 6.92 2.3732 2 2 6 6
38.41 3.73 2.3437 3 1 5 6
39.75 1.00 2.2674 2 0 14 3
40.43 7.18 2.2313 1 0 16 3
40.68 1.73 2.2182 1 1 15 6
41.71 12.64 2.1657 4 0 4 3
42.32 1.56 2.1358 0 3 12 3
42.32 11.94 2.1358 3 0 12 3
43.62 3.04 2.0749 1 2 14 6
44.11 3.04 2.0532 1 3 10 6
44.21 3.27 2.0486 0 0 18 1
44.25 1.95 2.0471 0 2 16 3
44.59 5.38 2.0321 2 3 2 6
45.20 11.00 2.0060 0 4 8 3
45.44 4.97 1.9961 3 2 4 6
46.01 6.31 1.9726 2 2 12 6
46.71 1.05 1.9448 4 1 0 6
47.69 22.76 1.9070 4 0 10 3
48.72 16.75 1.8690 2 3 8 6
49.14 6.66 1.8542 1 4 6 6
49.14 6.99 1.8542 4 1 6 6
50.55 4.72 1.8055 0 1 20 3
51.08 6.84 1.7881 3 2 10 6
51.51 5.40 1.7742 5 0 2 3
52.27 7.51 1.7500 0 5 4 3
53.42 1.81 1.7151 3 3 0 6
53.81 24.97 1.7037 2 0 20 3
54.40 1.45 1.6865 0 3 18 3
54.40 5.29 1.6865 3 0 18 3
54.43 1.71 1.6856 1 3 16 6
55.25 5.45 1.6625 5 0 8 3
55.46 1.53 1.6568 2 4 4 6
55.95 1.10 1.6433 1 4 12 6
55.95 1.47 1.6433 4 1 12 6
56.94 2.26 1.6173 1 2 20 6
57.02 2.84 1.6151 2 3 14 6
57.42 1.33 1.6048 0 5 10 3
57.54 1.53 1.6019 4 0 16 3
58.32 1.37 1.5821 3 3 9 6
58.33 2.23 1.5819 4 2 8 6
58.53 2.24 1.5771 5 1 4 6
58.87 1.11 1.5688 0 2 22 3
60.43 7.45 1.5320 2 4 10 6
60.54 6.60 1.5295 3 2 16 6
61.31 2.88 1.5121 1 5 8 6
61.83 3.16 1.5006 2 1 22 6
61.96 1.29 1.4977 3 3 12 6
62.53 3.16 1.4854 6 0 0 3
64.39 3.19 1.4470 4 3 4 6
65.39 2.28 1.4271 5 2 0 6
65.74 2.24 1.4205 0 4 20 3
66.27 1.72 1.4104 1 4 18 6
67.02 3.61 1.3963 3 4 8 6
67.36 1.63 1.3901 2 5 6 6
67.36 3.23 1.3901 5 2 6 6
68.53 4.01 1.3692 2 3 20 6
71.52 1.27 1.3191 2 2 24 6
71.78 1.23 1.3151 3 3 18 6
72.28 1.50 1.3071 1 2 26 6
73.11 1.31 1.2943 5 2 12 6
73.64 3.36 1.2864 4 4 0 6
74.58 1.14 1.2724 3 5 1 6
74.74 2.44 1.2701 5 3 2 6
76.63 4.12 1.2435 4 2 20 6
77.14 1.03 1.2364 4 3 16 6
77.39 1.82 1.2331 2 6 2 6
77.69 1.30 1.2292 0 0 30 1
77.83 1.51 1.2272 5 3 8 6
78.00 1.41 1.2249 6 2 4 6
81.04 1.52 1.1866 4 4 12 6
81.55 1.78 1.1804 7 1 0 6
82.35 1.86 1.1710 2 5 18 6
82.83 1.17 1.1653 2 3 26 6
87.54 2.51 1.1144 7 0 16 3
88.00 2.03 1.1098 5 0 26 3
88.07 4.76 1.1091 2 2 30 6
88.26 1.44 1.1072 3 2 28 6
88.79 1.06 1.1019 7 1 12 6
================================================================================
XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.