COL ICSD Collection Code 39728 DATE Recorded Jun 30, 1994 NAME Potassium niobium cyclo-trigermanate oxide (3.8/5/3/11.4) FORM K3.8 Nb5 (Ge3 O9) O11.4 = Ge3 K3.8 Nb5 O20.4 TITL Crystal structure of a new circled germanate K3.8Nb5(Ge3O9)O11.4 REF Zhurnal Neorganicheskoi Khimii ZNOKA 38 (1993) 1455-1460 AUT Belokoneva E L, Mill'ÿBÿV, ButashinÿAÿV CELL a=7.064 b=12.177 c=22.113 à=90.0 á=90.0 ç=90.0 V=1902.1 Z=4 SGR P b c 21 (29) - orthorhombic CLAS mm2 (Hermann-Mauguin) - C2v (Schoenflies) PRS oP129 ANX A12B15C20X82 PARM Atom__No OxStat Wyck ---X--- ---Y--- ---Z--- -SOF- Nb 1 5.000 4a -0.2122 -0.0816 0.1345 Nb 2 5.000 4a -0.292 -0.0805 0.366 Nb 3 5.000 4a -0.0525 0.0231 0.4985 Nb 4 5.000 4a 0.5476 0.0261 0.0019 Nb 5 5.000 4a -0.2223 -0.2591 0.0018 Ge 1 4.000 4a -0.2471 0.1062 1/4 Ge 2 4.000 4a 0.0353 -0.1692 0.2556 Ge 3 4.000 4a 0.463 -0.1742 0.2426 K 1 1.000 4a -0.245 0.243 0.094 K 2 1.000 4a -0.265 0.253 0.403 0.8 K 3 1.000 4a -0.267 -0.091 0.653 K 4 1.000 4a -0.243 -0.079 0.85 O 1 -2.000 4a 0.598 0.198 0.214 O 2 -2.000 4a 0.931 0.193 0.287 O 3 -2.000 4a 0.501 0.041 0.914 O 4 -2.000 4a 0.998 0.053 0.586 O 5 -2.000 4a 0.862 0.04 0.19 O 6 -2.000 4a 0.634 0.001 0.087 O 7 -2.000 4a 0.619 0.039 0.305 O 8 -2.000 4a 0.893 0.026 0.416 O 9 -2.000 4a 0.224 0.203 0.915 O 10 -2.000 4a 0.265 0.218 0.587 O 11 -2.000 4a 0.659 0.067 0.52 O 12 -2.000 4a 0.731 0.113 0.782 O 13 -2.000 4a 0.811 0.059 0.981 O 14 -2.000 4a 0.11 0.116 0.812 O 15 -2.000 4a 0.409 0.183 0.812 O 16 -2.000 4a 0.47 0.08 0.69 O 17 -2.000 4a 0.079 0.187 0.69 O 18 -2.000 4a 0.519 0.191 0.002 O 19 -2.000 4a 0.028 0.158 0.483 O 20 -2.000 4a 0.163 0.11 0.483 0.5 O 21 -2.000 4a 0.371 0.124 0.471 WYCK a33 ITF Nb 1 B=1.9(2) ITF Nb 2 B=2.8(2) ITF Nb 3 B=2.6(2) ITF Nb 4 B=3.7(2) ITF Nb 5 B=4.0(2) ITF Ge 1 B=0.92(6) ITF Ge 2 B=1.8(2) ITF Ge 3 B=1.7(2) ITF K 1 B=3.8(5) ITF K 2 B=3.7(7) ITF K 3 B=2.7(4) ITF K 4 B=2.6(4) ITF O 1 B=1.1(15) ITF O 2 B=1.9(6) ITF O 3 B=2.5(6) ITF O 4 B=1.4(5) ITF O 5 B=1.3(4) ITF O 6 B=1.4(5) ITF O 7 B=1.0(5) ITF O 8 B=1.7(6) ITF O 9 B=4.3(11) ITF O 10 B=6.8(11) ITF O 11 B=9.1(14) ITF O 12 B=2.4(6) ITF O 13 B=3.0(8) ITF O 14 B=3.1(8) ITF O 15 B=6.6(12) ITF O 16 B=0.8(4) ITF O 17 B=5.0(9) ITF O 18 B=6.5(10) ITF O 19 B=4.7(9) ITF O 20 B=9.9(23) ITF O 21 B=8.8(2) RVAL 0.079 TEST Difference between the formula calculated from the PARM record and the FORM record tolerable. (Code 21) TEST Deviation of the charge sum from zero tolerable. (Code 22)