NaNi2S2O10H3 Krickl R, Wildner M European Journal of Mineralogy 19 (2007) 805-816 Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 293 K _database_code_amcsd 0007248 CELL PARAMETERS: 8.6050 6.1850 7.3360 90.000 114.780 90.000 SPACE GROUP: C2/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 354.486 Density (g/cm3): 3.443 MAX. ABS. INTENSITY / VOLUME**2: 17.83454238 RIR: 1.687 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.29 100.00 6.6605 0 0 1 2 18.29 26.70 4.8493 1 1 0 4 19.64 8.42 4.5196 -1 1 1 4 21.00 11.44 4.2312 -2 0 1 2 22.76 15.86 3.9063 2 0 0 2 25.38 10.52 3.5099 1 1 1 4 26.77 5.79 3.3303 0 0 2 2 26.93 65.19 3.3102 -2 0 2 2 28.29 41.34 3.1548 -1 1 2 4 31.02 60.49 2.8832 2 0 1 2 31.91 49.18 2.8049 0 2 1 4 34.48 15.79 2.6011 -3 1 1 4 35.97 63.91 2.4967 -2 2 1 4 36.49 9.43 2.4625 1 1 2 4 36.74 8.28 2.4463 -3 1 2 4 37.08 5.44 2.4247 2 2 0 4 37.26 4.25 2.4130 -2 0 3 2 39.78 7.07 2.2661 0 2 2 4 39.89 32.48 2.2598 -2 2 2 4 40.64 3.30 2.2202 0 0 3 2 42.41 23.03 2.1313 2 0 2 2 42.42 1.72 2.1309 -4 0 1 2 42.74 2.16 2.1156 -4 0 2 2 46.11 1.03 1.9684 -1 3 1 4 46.49 8.77 1.9532 4 0 0 2 47.81 15.33 1.9024 -2 2 3 4 49.09 1.70 1.8560 1 3 1 4 49.39 3.73 1.8451 1 1 3 4 50.61 13.16 1.8035 0 2 3 4 52.12 8.55 1.7549 2 2 2 4 52.13 10.28 1.7547 -4 2 1 4 52.40 3.31 1.7461 -4 2 2 4 54.19 1.83 1.6925 4 0 1 2 54.85 4.51 1.6738 -3 3 1 4 55.16 9.97 1.6651 0 0 4 2 55.52 12.33 1.6551 -4 0 4 2 55.52 1.46 1.6551 2 0 3 2 55.66 13.26 1.6514 4 2 0 4 56.44 24.36 1.6303 -4 2 3 4 56.97 2.55 1.6164 3 3 0 4 58.51 8.79 1.5774 -2 2 4 4 59.81 13.23 1.5462 0 4 0 2 61.57 2.82 1.5062 0 4 1 4 62.56 9.79 1.4847 4 2 1 4 63.45 3.48 1.4661 0 2 4 4 63.66 2.25 1.4618 -2 0 5 2 63.78 1.99 1.4593 -4 2 4 4 63.78 8.62 1.4592 2 2 3 4 64.12 1.00 1.4523 -2 4 1 4 64.66 4.70 1.4416 4 0 2 2 64.85 3.19 1.4377 2 4 0 4 66.27 2.86 1.4104 -6 0 3 2 66.28 1.71 1.4102 1 3 3 4 66.33 2.78 1.4093 -4 0 5 2 66.69 2.19 1.4025 0 4 2 4 66.77 4.46 1.4009 -2 4 2 4 67.23 1.62 1.3925 -6 0 1 2 67.65 1.61 1.3848 3 1 3 4 68.91 9.18 1.3627 2 4 1 4 70.74 2.28 1.3318 -6 0 4 2 71.37 2.22 1.3216 -2 2 5 4 71.47 1.19 1.3200 -5 3 2 4 72.62 1.54 1.3019 -2 4 3 4 72.71 8.54 1.3006 -6 2 2 4 73.09 1.02 1.2947 -5 1 5 4 74.77 3.82 1.2697 -6 2 1 4 74.83 1.44 1.2688 0 4 3 4 76.04 3.41 1.2516 2 4 2 4 76.05 1.32 1.2515 -4 4 1 4 76.27 1.78 1.2484 -4 4 2 4 78.12 7.11 1.2234 0 2 5 4 78.26 1.08 1.2216 -6 0 5 2 78.97 1.31 1.2123 4 4 0 4 79.20 3.47 1.2094 -2 0 6 2 79.99 2.34 1.1994 -3 1 6 4 82.25 1.73 1.1721 -1 5 2 4 82.44 1.17 1.1700 3 3 3 4 84.65 1.25 1.1449 4 2 3 4 85.45 2.07 1.1362 -6 2 5 4 85.75 2.84 1.1331 0 4 4 4 86.05 3.51 1.1299 -4 4 4 4 88.11 1.78 1.1087 6 2 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.