21-0006
Al0.5Fe0.5{PO3}3
Triklin
Dexp Dcal d(D) h k l
5.3802 5.3822 -.0020 2 2 0
5.2004 5.1942 .0062 1 0 1
4.6004 4.6005 -.0002 3 0 0
4.3804 4.3796 .0007 3 2 0
4.2403 4.2415 -.0011 -2 -2 1
3.8302 3.8298 .0004 1 2 1
3.7303 3.7311 -.0008 -2 1 1
3.6303 3.6300 .0003 2 2 1
3.5303 3.5301 .0002 4 2 0
3.3802 3.3809 -.0007 -1 3 0
3.2203 3.2202 .0000 3 -1 1
3.1402 3.1393 .0009 4 3 0
A= 14.7182 DA= .0006
B= 12.2799 DB= .0008
C= 5.7371 DC= .0004
GAMMA= 69.720 DGAMMA= .001
BETA = 94.468 DBETA = .009
ALPHA= 99.332 DALPHA= .007
V=938.8
21-0026
NH4FeP2O7
Triklin
Dexp Dcal d(D) h k l
5.8606 5.8784 -.0178 0 1 1
5.3405 5.3307 .0099 -1 1 0
5.0105 4.9998 .0106 2 1 1
4.2506 4.2321 .0185 1 2 1
3.9704 3.9657 .0047 0 2 0
3.4403 3.4404 -.0001 2 -1 1
3.3103 3.3128 -.0024 2 2 2
3.1104 3.1149 -.0046 3 1 2
3.0304 3.0282 .0022 1 -1 2
3.0003 2.9962 .0041 -2 1 1
2.9803 2.9819 -.0016 -1 0 2
2.6503 2.6533 -.0030 0 3 1
A= 10.5773 DA= .0006
B= 8.719 DB= .003
C= 7.906 DC= .006
GAMMA= 68.10 DGAMMA= .04
BETA = 65.59 DBETA = .02
ALPHA= 71.31 DALPHA= .04
V=604.2
21-0369
H2{Al0.7Fe0.3}P3O10
Monoklin
Grupa 4,11
Dexp Dcal d(D) h k l
6.8503 6.8602 -.0099 1 1 0
5.6803 5.6933 -.0130 2 0 0
5.4703 5.4781 -.0079 0 1 1
5.2903 5.2851 .0052 -1 1 1
4.7403 4.7465 -.0062 2 1 0
4.6404 4.6490 -.0086 1 1 1
4.3002 4.2976 .0026 0 2 0
4.0202 4.0208 -.0005 1 2 0
3.6803 3.6778 .0025 0 2 1
3.5503 3.5546 -.0043 0 0 2
3.4302 3.4301 .0001 2 2 0
3.3902 3.3896 .0006 -3 1 1
a= 11.651 b= 8.595 c= 7.2743 beta= 102.2
da=.009 db= .001 dc= .0004 dbet=.1
V= 711.9
Triklin
Dexp Dcal d(D) h k l
6.8503 6.8545 -.0042 0 1 1
5.6803 5.6812 -.0009 -1 0 1
5.4703 5.4679 .0024 0 -1 1
5.2903 5.2870 .0033 0 2 0
4.7403 4.7445 -.0041 -1 2 0
4.6404 4.6502 -.0098 -1 -1 1
4.3002 4.2985 .0017 -1 2 1
4.0202 4.0229 -.0027 -2 0 1
3.6803 3.6838 -.0035 0 0 2
3.5503 3.5490 .0012 -1 -2 1
3.4302 3.4272 .0030 0 2 2
3.3902 3.3891 .0011 1 3 1
A= 10.56 DA= .01
B= 10.886 DB= .006
C= 7.652 DC= .004
GAMMA= 88.92 DGAMMA= .06
BETA = 82.35 DBETA = .08
ALPHA= 76.28 DALPHA= .05
V= 847.2
21-0377
H2FeP3O10
Triklin
Dexp Dcal d(D) h k l
6.9406 6.9460 -.0053 -1 0 1
5.9203 5.9350 -.0148 1 2 0
5.6803 5.6966 -.0163 1 1 2
5.5502 5.5742 -.0240 1 -1 1
5.3605 5.3556 .0050 2 1 1
4.7704 4.7606 .0098 0 -2 1
4.6804 4.6800 .0004 2 2 0
4.3804 4.3791 .0012 0 2 2
4.2803 4.2786 .0018 -2 0 1
4.0902 4.0893 .0009 2 0 2
3.8503 3.8487 .0016 0 0 3
3.7402 3.7388 .0014 0 -3 0
A= 10.961 DA= .008
B= 12.4834 DB= .0007
C= 12.055 DC= .001
GAMMA= 65.46 DGAMMA= .03
BETA = 75.87 DBETA = .05
ALPHA= 76.16 DALPHA= .06
V=1432
21-0421
Fe3AsO7
Monoklin
Grupa 4,11
Dexp Dcal d(D) h k l
5.1905 5.1981 -.0076 3 0 1
4.8802 4.8662 .0140 -1 0 2
4.1504 4.1499 .0005 0 2 0
3.9802 3.9764 .0038 4 0 1
3.8702 3.8805 -.0103 4 0 0
3.4402 3.4304 .0098 3 0 3
3.3803 3.3865 -.0062 2 1 3
3.3602 3.3630 -.0028 -2 2 1
3.2503 3.2431 .0071 3 2 1
3.2303 3.2303 .0000 2 2 2
3.2003 3.1980 .0023 5 0 1
3.1096 3.1044 .0052 5 0 0
a= 16.00 b= 8.300 c= 11.447 beta= 75.9
da=.01 db=.008 dc=.001 dbet= .11
V= 1475
21-0422
FeB4O7
Triklin
Dexp Dcal d(D) h k l
6.1004 6.0979 .0026 0 1 1
5.5005 5.4968 .0037 1 0 0
4.2004 4.2066 -.0063 0 -1 1
3.4903 3.4897 .0006 -1 -1 1
3.3502 3.3517 -.0014 1 0 2
3.1702 3.1683 .0019 2 1 1
2.9202 2.9210 -.0008 2 1 0
2.8702 2.8728 -.0026 2 1 2
2.5002 2.4994 .0008 -1 2 1
2.2402 2.2404 -.0002 0 3 0
2.0001 1.9996 .0005 1 4 2
1.9391 1.9402 -.0011 2 3 4
A= 6.359 DA= .004
B= 8.117 DB= .007
C= 8.307 DC= .002
GAMMA= 62.38 DGAMMA= .03
BETA = 67.05 DBETA = .02
ALPHA= 61.90 DALPHA= .02
V= 326.95
21-0424
Fe2B2O5*H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
6.4003 6.4093 -.0090 1 1 0
5.4005 5.3940 .0065 2 0 1
3.9502 3.9430 .0072 0 2 1
3.7702 3.7645 .0057 -1 0 2
3.4003 3.3977 .0026 1 2 2
3.3102 3.3104 -.0002 2 1 3
2.7402 2.7391 .0010 1 3 1
2.6402 2.6402 .0000 2 1 4
2.5902 2.5896 .0006 1 1 4
2.5202 2.5211 -.0009 3 2 3
2.4602 2.4615 -.0013 2 3 0
2.3801 2.3810 -.0008 0 1 4
a= 10.795 b= 8.595 c= 11.123 beta= 63.00
da=.009 db=.004 dc= .001 dbeta=.05
V= 920
Triklin
Dexp Dcal d(D) h k l
6.4003 6.4014 -.0011 1 0 0
5.4005 5.4021 -.0016 0 1 1
3.9502 3.9561 -.0058 0 -1 1
3.7702 3.7647 .0055 0 2 1
3.4003 3.4029 -.0026 -1 2 1
3.3102 3.3079 .0023 1 2 0
2.7402 2.7411 -.0009 -1 0 2
2.6402 2.6415 -.0014 -1 -2 1
2.5902 2.5892 .0010 2 0 1
2.5202 2.5214 -.0013 -1 3 1
2.4602 2.4609 -.0007 1 -2 1
2.3801 2.3838 -.0036 1 3 0
A= 6.5072 DA= .0004
B= 8.087 DB= .004
C= 5.9867 DC= .0006
GAMMA= 92.533 DGAMMA= .008
BETA =100.327 DBETA = .007
ALPHA= 71.373 DALPHA= .003
V= 293.6
21-0425
Fe6B14O27*H2O
Triklin
Dexp Dcal d(D) h k l
6.4003 6.4259 -.0256 1 0 0
6.1004 6.0931 .0073 0 1 1
4.9004 4.8960 .0044 0 -1 1
4.4004 4.3976 .0028 -1 -1 1
4.3003 4.2884 .0120 0 0 2
4.0003 3.9912 .0091 -1 0 2
3.6502 3.6504 -.0002 -1 1 2
3.5303 3.5320 -.0017 1 -1 1
3.2202 3.2129 .0073 2 0 0
3.1402 3.1429 -.0027 1 2 1
3.0402 3.0465 -.0063 0 2 2
2.7202 2.7202 .0000 1 2 2
A= 6.616 DA= .002
B= 7.154 DB= .002
C= 8.962 DC= .004
GAMMA= 84.40 DGAMMA= .02
BETA =101.17 DBETA = .01
ALPHA= 78.701 DALPHA= .003
V= 404.0
21-0426
FeB4O7*0.8H2O
Triklin
Dexp Dcal d(D) h k l
6.4003 6.3739 .0264 -1 0 1
5.4005 5.3985 .0020 1 1 0
5.0004 4.9972 .0032 -1 -1 2
4.5003 4.5080 -.0077 0 1 2
3.7302 3.7261 .0042 -1 1 0
3.6002 3.6002 .0000 -1 1 1
3.4903 3.4897 .0005 2 1 0
3.3602 3.3581 .0021 -1 1 2
3.2599 3.2671 -.0072 2 0 1
3.0902 3.0876 .0026 2 0 2
3.0602 3.0628 -.0026 -1 1 3
2.9402 2.9421 -.0019 1 -1 4
A= 7.2293 DA= .0001
B= 6.1766 DB= .0001
C= 17.94600 DC= .00006
GAMMA= 68.289 DGAMMA= .001
BETA = 96.03132 DBETA = .00007
ALPHA= 99.5340 DALPHA= .0004
V=733.6
21-0913
Ca4Fe9O17
Rombik
Groupa 26,28,51
Dexp. Dcal. d(D) h k l
5.6205 5.6155 .0050 0 2 0
3.7402 3.7437 -.0034 0 3 0
2.9902 2.9913 -.0011 0 3 2
2.8052 2.8077 -.0026 0 4 0
2.6652 2.6703 -.0051 1 2 1
2.4922 2.4875 .0047 0 0 4
2.2442 2.2462 -.0020 0 5 0
2.0621 2.0612 .0009 1 4 1
1.8381 1.8361 .0020 1 5 0
1.7361 1.7371 -.0010 1 3 4
1.5781 1.5779 .0002 2 1 0
a= 3.187 b=11.23 c= 9.950
da= .001 db= .01 dc= .001
v= 356.2
21-0914
CaFe3O5
Triklin
Dexp Dcal d(D) h k l
6.3204 6.3185 .0019 1 1 0
2.8192 2.8189 .0004 0 0 1
2.6762 2.6776 -.0014 0 -2 1
2.6312 2.6308 .0004 1 2 1
2.5011 2.5029 -.0017 0 -3 1
2.3842 2.3837 .0005 2 1 1
2.2542 2.2540 .0002 -1 2 1
2.2071 2.2069 .0003 0 4 1
2.1112 2.1108 .0003 2 6 0
1.9731 1.9742 -.0010 -1 7 0
1.9371 1.9375 -.0004 3 1 1
1.7001 1.6995 .0006 1 -7 1
A= 6.7909 DA= .0003
B= 15.094 DB= .004
C= 2.8788 DC= .0008
GAMMA= 83.956 DGAMMA= .009
BETA = 78.57 DBETA = .01
ALPHA= 91.26 DALPHA= .02
V= 287.3
21-0915
CaFe5O7
Triklin
Dexp Dcal d(D) h k l
8.3508 8.3473 .0035 0 0 1
2.9552 2.9555 -.0003 0 -2 1
2.6052 2.6048 .0004 1 2 0
2.5762 2.5761 .0001 2 1 1
2.5342 2.5346 -.0004 0 -2 2
2.5002 2.4990 .0011 -1 -2 1
2.4742 2.4742 -.0000 1 2 1
2.2921 2.2927 -.0006 1 1 3
2.2692 2.2693 -.0002 2 1 2
2.2181 2.2174 .0008 -2 2 2
2.1802 2.1813 -.0012 -3 0 1
2.1541 2.1538 .0004 -1 3 0
A= 7.020 DA= .007
B= 6.474 DB= .001
C= 8.351 DC= .003
GAMMA=104.63 DGAMMA= .03
BETA = 89.22 DBETA = .07
ALPHA= 91.558 DALPHA= .005
V= 367.1
21-0916
Ca3Fe15O25
Triklin
Dexp Dcal d(D) h k l
5.2203 5.2140 .0063 0 0 1
4.8603 4.8637 -.0034 -1 0 1
3.1302 3.1280 .0022 0 -2 1
2.9702 2.9709 -.0006 -1 2 1
2.6832 2.6832 .0000 -1 1 2
2.6192 2.6190 .0002 -2 1 1
2.5882 2.5884 -.0002 0 3 0
2.5442 2.5447 -.0005 2 0 0
2.1552 2.1551 .0001 0 2 2
1.9921 1.9921 -.0000 1 0 2
1.8401 1.8400 .0001 -3 -1 1
1.5621 1.5624 -.0003 -1 -3 3
A= 5.672 DA= .003
B= 7.774 DB= .002
C= 5.807 DC= .001
GAMMA= 87.37 DGAMMA= .01
BETA =116.12 DBETA = .03
ALPHA= 91.65 DALPHA= .01
V= 229.6
21-0918
FeMo2S4
Triklin
Dexp Dcal d(D) h k l
5.8204 5.8195 .0009 -1 0 1
5.1205 5.1207 -.0002 -1 1 1
3.3403 3.3407 -.0004 -1 2 2
2.9402 2.9396 .0006 -2 -1 1
2.8902 2.8894 .0009 0 3 1
2.5802 2.5814 -.0012 1 3 0
2.5102 2.5103 -.0001 -2 1 3
2.2602 2.2596 .0005 -2 -1 3
2.1602 2.1605 -.0004 1 3 3
2.1302 2.1304 -.0002 0 4 2
2.0702 2.0698 .0003 0 3 4
2.0301 2.0297 .0004 1 0 4
A= 6.4865 DA= .0004
B= 8.675 DB= .003
C= 9.767 DC= .006
GAMMA= 91.310 DGAMMA= .009
BETA =101.96 DBETA = .01
ALPHA= 74.31 DALPHA= .04
V= 517.3
21-0920
eta-Fe2O3
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
6.0106 6.0016 .0089 1 1 0
4.3602 4.3546 .0056 0 2 0
4.1504 4.1497 .0007 0 1 1
3.6002 3.6004 -.0002 1 1 1
3.0002 3.0008 -.0006 2 2 0
2.7402 2.7397 .0005 1 3 0
2.4002 2.3999 .0003 -1 3 1
2.0001 2.0005 -.0004 3 3 0
1.8701 1.8699 .0003 4 2 0
1.8101 1.8102 -.0001 -2 4 1
1.5801 1.5801 -.0000 3 4 1
a= 8.31 b= 8.709 c= 4.738 beta= 95.0
da=.01 db=.005 dc=.006 dbeta=.1
V= 341.8
21-0921
Fe6S8O33
Triklin
Dexp Dcal d(D) h k l
6.0004 6.0148 -.0144 1 1 0
5.8105 5.8169 -.0064 -1 0 1
5.3005 5.3016 -.0010 1 -1 1
5.2705 5.2769 -.0064 -1 1 0
4.3803 4.3730 .0073 1 -1 2
4.2602 4.2661 -.0058 0 1 2
4.1803 4.1766 .0037 2 0 2
4.1402 4.1412 -.0010 2 1 1
4.0002 3.9924 .0078 -1 0 2
3.7302 3.7175 .0127 2 -1 1
3.6602 3.6645 -.0043 -1 -1 2
3.6103 3.6104 -.0001 0 0 3
A= 9.3069 DA= .0004
B= 7.44547 DB= .00001
C= 11.5898 DC= .0002
GAMMA= 82.990 DGAMMA= .003
BETA = 69.348 DBETA = .003
ALPHA= 90.188 DALPHA= .003
V=745.4
21-0922
beta-Fe4S5O21
Triklin
Dexp Dcal d(D) h k l
6.0106 6.0070 .0035 -2 -1 1
5.8303 5.8310 -.0007 2 1 0
5.3103 5.3090 .0013 -1 1 1
4.3803 4.3796 .0007 -3 -1 1
4.2804 4.2797 .0006 -1 1 2
4.1803 4.1804 -.0001 -3 0 1
4.1504 4.1505 -.0001 -2 1 1
4.0102 4.0085 .0017 -2 -2 2
3.7403 3.7408 -.0005 -1 -2 3
3.6203 3.6196 .0007 -2 -2 3
3.5702 3.5703 -.0001 0 -1 4
3.5403 3.5396 .0007 1 1 3
A= 13.470 DA= .005
B= 8.818 DB= .001
C= 14.719 DC= .002
GAMMA= 72.173 DGAMMA= .006
BETA =100.24 DBETA = .03
ALPHA=107.80 DALPHA= .01
V=1577.5
21-0923
Fe12S11O51
Triklin
Dexp Dcal d(D) h k l
5.9803 5.9901 -.0098 2 0 0
5.2905 5.2853 .0051 2 0 1
4.8904 4.8884 .0020 0 3 1
4.3404 4.3377 .0027 0 2 2
4.1402 4.1425 -.0022 0 4 0
3.7202 3.7195 .0008 3 1 0
3.6002 3.6011 -.0009 -2 2 2
3.4303 3.4316 -.0013 2 2 2
3.2403 3.2402 .0001 -2 -2 2
3.2003 3.2005 -.0003 -1 5 1
3.1703 3.1695 .0008 0 5 1
3.0002 2.9981 .0021 2 0 3
A= 12.238 DA= .004
B= 16.900 DB= .001
C= 10.053 DC= .001
GAMMA=101.27 DGAMMA= .09
BETA = 86.76 DBETA = .05
ALPHA= 89.29 DALPHA= .05
V=2035
21-0924
alfa-Fe4S5O21
Triklin
Dexp Dcal d(D) h k l
6.0106 5.9969 .0136 -1 0 1
4.3702 4.3651 .0052 1 -2 1
4.1303 4.1299 .0005 -1 2 1
3.9802 3.9765 .0037 -1 1 2
3.8503 3.8520 -.0017 1 0 2
3.6002 3.5932 .0070 -1 -2 1
2.9972 2.9985 -.0012 -2 0 2
2.7422 2.7424 -.0002 2 -2 2
2.6812 2.6822 -.0010 -1 -2 3
2.4232 2.4233 -.0001 -2 -2 2
2.3822 2.3824 -.0002 0 -4 2
2.2641 2.2627 .0014 1 2 3
A= 7.197 DA= .002
B= 10.4442 DB= .0007
C= 10.1271 DC= .0002
GAMMA=104.92 DGAMMA= .01
BETA = 94.051 DBETA = .001
ALPHA= 97.5484 DALPHA= .0005
V=724.5
21-0926
Fe6S8O33*2H2O
Triklin
Dexp Dcal d(D) h k l
9.2502 9.2138 .0364 -1 0 1
8.5306 8.5806 -.0499 0 1 0
5.8406 5.8316 .0091 -1 1 0
5.3504 5.3477 .0027 1 -1 1
5.3005 5.3037 -.0032 -1 1 1
4.8802 4.8835 -.0033 2 0 0
4.8203 4.8220 -.0018 1 0 2
4.2904 4.2903 .0001 0 -2 0
4.1903 4.1924 -.0021 2 0 1
4.0202 4.0180 .0022 -2 -2 1
3.7502 3.7490 .0012 -2 -2 3
3.6703 3.6703 .0000 1 2 1
A= 10.810 DA= .002
B= 9.442 DB= .003
C= 14.65 DC= .01
GAMMA= 70.801 DGAMMA= .008
BETA =112.03 DBETA = .01
ALPHA=111.19 DALPHA= .03
V=1261
21-0927
Fe2S2O9*5H2O
Triklin
Dexp Dcal d(D) h k l
6.1904 6.1903 .0000 -1 0 1
5.5603 5.5570 .0033 0 1 1
5.0004 4.9988 .0016 0 -1 1
4.7504 4.7442 .0062 -1 1 1
4.4404 4.4402 .0001 1 -1 1
4.1402 4.1394 .0009 -2 0 1
3.9303 3.9187 .0116 -2 1 0
3.6903 3.6951 -.0048 0 1 2
3.6002 3.5912 .0090 -2 1 1
3.2403 3.2482 -.0079 3 0 0
3.1703 3.1695 .0008 -1 -1 2
3.0802 3.0804 -.0002 -1 2 1
A= 9.75274 DA= .00001
B= 6.89337 DB= .00001
C= 8.24574 DC= .00001
GAMMA= 88.21858 DGAMMA= .00003
BETA = 88.28419 DBETA = .00006
ALPHA= 83.80577 DALPHA= .00001
V=550.6
21-0928
Fe2S2O9*xH2O
Triklin
Dexp Dcal d(D) h k l
5.0504 5.0575 -.0071 1 0 0
4.7504 4.7515 -.0012 0 1 0
3.5602 3.5607 -.0004 0 -1 2
3.2503 3.2564 -.0062 1 0 2
3.2003 3.2010 -.0007 0 1 2
2.2832 2.2820 .0012 -1 2 0
2.2282 2.2286 -.0004 0 -1 4
2.1331 2.1322 .0009 -2 -1 1
2.0461 2.0464 -.0003 0 1 4
1.9921 1.9927 -.0005 2 1 1
1.8421 1.8431 -.0009 -1 -2 3
1.8311 1.8320 -.0008 2 -2 1
A= 5.151 DA= .001
B= 4.8214 DB= .0001
C= 9.668 DC= .002
GAMMA= 97.66 DGAMMA= .01
BETA = 97.039 DBETA = .005
ALPHA= 95.059 DALPHA= .003
V= 234.8
21-0929
Fe6S4O21*xH2O
Triklin
Dexp Dcal d(D) h k l
5.9702 5.9718 -.0015 1 0 0
5.0803 5.0633 .0170 -1 1 0
3.7002 3.6981 .0022 -1 1 1
3.4703 3.4686 .0017 1 1 0
3.1502 3.1454 .0047 -2 1 0
3.0702 3.0689 .0014 0 -1 1
3.0202 3.0197 .0006 1 -1 1
2.9862 2.9859 .0003 2 0 0
2.9352 2.9359 -.0007 -1 2 0
2.7522 2.7515 .0007 0 2 0
2.5322 2.5316 .0006 -2 2 0
2.2971 2.2984 -.0013 2 1 0
A= 6.42058 DA= .00009
B= 6.107 DB= .003
C= 4.521 DC= .001
GAMMA=111.48 DGAMMA= .03
BETA = 93.68 DBETA = .01
ALPHA= 75.21 DALPHA= .04
V= 159.4
21-0930
Fe14S18O75*xH2O
Triklin
Dexp Dcal d(D) h k l
4.7602 4.7575 .0027 0 1 0
3.6002 3.6011 -.0009 1 0 1
3.3002 3.3046 -.0044 0 -1 2
3.2802 3.2819 -.0017 -1 -1 1
3.1602 3.1613 -.0011 1 1 1
2.5622 2.5629 -.0007 1 1 2
2.2561 2.2560 .0001 1 0 3
2.0221 2.0223 -.0001 1 -1 3
2.0061 2.0067 -.0005 2 1 0
1.8511 1.8515 -.0004 -1 -2 3
1.8371 1.8371 .0000 1 -2 1
1.7121 1.7120 .0002 -1 2 1
A= 4.053 DA= .001
B= 5.006 DB= .001
C= 7.9696 DC= .0009
GAMMA= 74.4135 DGAMMA= .0004
BETA = 88.03 DBETA = .03
ALPHA= 98.46 DALPHA= .03
V= 153.6
21-0931
Fe3SO9*5H2O
Triklin
Dexp Dcal d(D) h k l
8.0003 7.9718 .0284 1 0 0
7.5208 7.5209 -.0002 0 1 0
5.5003 5.5093 -.0090 1 0 1
5.0203 5.0460 -.0257 0 1 1
4.3602 4.3760 -.0157 1 -1 1
4.2704 4.2794 -.0091 -1 0 1
3.9903 3.9859 .0044 2 0 0
3.7602 3.7605 -.0002 0 2 0
3.3302 3.3286 .0017 2 1 1
3.2202 3.2250 -.0048 1 2 0
3.1203 3.1199 .0004 -1 2 1
3.0603 3.0592 .0011 1 -2 1
A= 8.30 DA= .01
B= 7.65 DB= .002
C= 6.220 DC= .005
GAMMA= 96.50 DGAMMA= .05
BETA = 76.01 DBETA = .04
ALPHA= 83.56 DALPHA= .01
V= 376.9
21-1129
Na2Fe2Ti3O10
Triklin
Dexp Dcal d(D) h k l
7.3004 7.3097 -.0093 1 1 0
4.8403 4.8345 .0058 -1 2 0
3.5903 3.6005 -.0102 0 4 0
3.5003 3.5044 -.0041 1 4 0
3.0802 3.0785 .0017 0 -2 1
2.9802 2.9851 -.0049 1 -1 1
2.8702 2.8675 .0027 1 5 0
2.7102 2.7093 .0009 -1 -3 1
2.5302 2.5289 .0013 2 0 1
2.4402 2.4403 -.0001 -2 -2 1
2.2802 2.2800 .0002 -3 2 0
2.0802 2.0810 -.0008 1 7 0
A= 7.772 DA= .001
B= 14.6969 DB= .0007
C= 3.2651 DC= .0003
GAMMA= 80.04 DGAMMA= .06
BETA = 88.56 DBETA = .02
ALPHA= 95.43 DALPHA= .02
V=365.6
21-1130
NaFeTi3O8
Triklin
Dexp Dcal d(D) h k l
6.2204 6.2115 .0089 0 1 1
5.8503 5.8544 -.0041 0 -1 1
3.7603 3.7622 -.0019 1 0 1
3.6303 3.6320 -.0017 0 -1 2
3.1502 3.1515 -.0013 1 0 2
3.1002 3.1058 -.0056 0 2 2
3.0102 3.0052 .0050 1 -1 2
2.9402 2.9394 .0007 1 1 2
2.7102 2.7117 -.0015 -1 2 1
2.5302 2.5328 -.0027 1 2 2
2.4602 2.4577 .0025 -1 -2 1
2.3902 2.3876 .0025 0 2 3
A= 3.881 DA= .001
B= 8.976 DB= .002
C= 8.396 DC= .001
GAMMA= 94.92 DGAMMA= .05
BETA = 76.96 DBETA = .01
ALPHA= 87.81 DALPHA= .06
V= 283.4
21-1141
C9Fe2O9
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.0306 8.0290 .0016 1 1 0
5.5603 5.5563 .0040 2 1 1
5.2505 5.2568 -.0062 -2 0 1
4.5902 4.5943 -.0040 2 1 2
2.9832 2.9811 .0021 2 3 1
2.7542 2.7551 -.0009 -1 3 2
2.5212 2.5216 -.0005 -3 3 1
2.0591 2.0590 .0002 -6 1 1
1.8561 1.8563 -.0001 7 2 2
1.7621 1.7626 -.0005 6 3 4
1.7081 1.7082 -.0001 0 4 5
1.5491 1.5490 .0001 -2 5 4
1.4601 1.4602 -.0001 1 6 4
a= 14.020 b= 9.99 c= 12.167 beta= 74.2
da=.0093 db=.01 dc=.003 dbet=.1
V= 1639
Triklin
Dexp Dcal d(D) h k l
8.0306 8.0227 .0079 -1 0 1
5.5603 5.5574 .0028 0 -1 1
5.2505 5.2422 .0083 1 0 1
4.5902 4.5934 -.0032 -1 -1 2
2.9832 2.9807 .0025 -3 0 1
2.7542 2.7540 .0002 -2 -2 2
2.5212 2.5196 .0016 0 1 3
2.0591 2.0596 -.0004 4 0 0
1.8561 1.8559 .0003 3 2 1
1.7621 1.7622 -.0001 2 0 4
1.7081 1.7081 -.0000 -5 -2 3
1.5491 1.5490 .0001 3 -2 3
1.4601 1.4602 -.0001 -2 3 3
A= 9.2166 DA= .0001
B= 6.086 DB= .004
C= 10.83 DC= .03
GAMMA= 77.900 DGAMMA= .008
BETA =116.19 DBETA = .03
ALPHA=107.684 DALPHA= .002
V= 517.5
21-1355
Na2FeH4{PO4}3*3H2O
Triklin
Dexp Dcal d(D) h k l
7.6806 7.7137 -.0332 0 0 1
6.1004 6.0931 .0073 1 1 0
5.8303 5.8512 -.0209 0 -2 1
5.6903 5.6886 .0017 1 -1 1
4.4904 4.4880 .0024 -1 0 1
4.3803 4.3734 .0070 0 4 1
4.2504 4.2532 -.0028 -1 4 0
3.8803 3.8775 .0028 1 -4 1
3.8603 3.8569 .0034 0 0 2
3.7203 3.7213 -.0010 1 -1 2
3.6803 3.6832 -.0030 0 5 1
3.5302 3.5303 -.0001 1 -2 2
A= 6.9411 DA= .0005
B= 20.1451 DB= .0004
C= 8.0124 DC= .0004
GAMMA= 95.98 DGAMMA= .02
BETA = 75.179 DBETA = .005
ALPHA= 86.54 DALPHA= .01
V=1072.7
21-1356
NaFeH2{PO4}2*0.5H2O
Triklin
Dexp Dcal d(D) h k l
8.1511 8.1469 .0042 0 -1 1
7.2806 7.3075 -.0269 0 -1 2
6.4304 6.4382 -.0077 1 0 1
6.1004 6.1060 -.0056 -1 0 1
5.6903 5.7000 -.0096 1 1 1
4.7803 4.7757 .0046 -1 -1 3
4.5002 4.4917 .0085 1 -1 2
4.4304 4.4449 -.0146 0 -1 5
4.1703 4.1680 .0024 1 1 4
4.0403 4.0415 -.0012 -1 1 2
3.9902 3.9931 -.0029 0 0 6
3.9302 3.9332 -.0030 1 -1 4
A= 6.73950 DA= .00004
B= 8.5631 DB= .0002
C= 24.303 DC= .001
GAMMA= 75.591 DGAMMA= .003
BETA = 86.11 DBETA = .01
ALPHA= 97.572 DALPHA= .005
V=1339.1
21-1357
Na3Fe2{PO4}3*4H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
10.3007 10.2909 .0097 0 1 0
6.8004 6.8267 -.0263 0 1 1
5.1604 5.1455 .0149 0 2 0
4.9403 4.9451 -.0049 2 0 0
4.7404 4.7257 .0147 -2 0 1
4.4403 4.4572 -.0169 2 1 0
4.3004 4.2946 .0058 -2 1 1
4.1903 4.1702 .0201 0 1 2
4.1004 4.0963 .0041 -1 1 2
3.9602 3.9506 .0096 1 2 1
3.8803 3.8804 -.0001 1 0 2
3.7703 3.7668 .0036 2 1 1
a= 10.06 b= 10.29 c= 9.28 beta= 100.6
da=.01 db=.03 dc= .02 dbet=.2
V= 944
21-1358
Na3Fe{PO4}3*3H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
17.7026 17.6700 .0327 -1 0 1
6.0904 6.0937 -.0033 0 0 3
5.0804 5.0715 .0089 5 0 2
4.7803 4.7710 .0093 -7 0 2
4.5103 4.5067 .0036 6 0 2
3.9902 3.9917 -.0015 3 0 4
3.9102 3.9121 -.0018 -7 1 2
3.8303 3.8352 -.0049 -9 0 2
3.5602 3.5640 -.0038 1 0 5
3.3502 3.3529 -.0027 2 2 0
3.2602 3.2576 .0026 -3 2 1
3.2102 3.2090 .0012 -4 1 5
a= 35.420 b= 6.834 c= 18.64 beta= 101.32
da=.005 db=.006 dc=.01 dbeta=.05
V= 4425
Triklin
Dexp Dcal d(D) h k l
17.7026 17.7132 -.0106 1 0 0
6.0904 6.1019 -.0116 0 1 1
5.0804 5.0799 .0005 -2 -1 1
4.7803 4.7841 -.0038 3 0 1
4.5103 4.5181 -.0077 -3 1 0
3.9902 3.9918 -.0016 -4 0 1
3.9102 3.9115 -.0012 -2 0 2
3.8303 3.8272 .0031 1 1 2
3.5602 3.5588 .0014 1 -1 2
3.3502 3.3517 -.0015 -2 2 1
3.2602 3.2601 .0002 -3 -2 1
3.2102 3.2095 .0007 4 2 0
A= 17.8643 DA= .0001
B= 8.23646 DB= .00004
C= 8.58974 DC= .00000
GAMMA= 82.8246 DGAMMA= .0001
BETA = 91.58337 DBETA = .00003
ALPHA= 86.64072 DALPHA= .00009
V=1251.5
21-1359
Na3Fe{PO4}2*H2O
Triklin
Dexp Dcal d(D) h k l
7.6306 7.6135 .0171 1 0 0
7.5808 7.6070 -.0262 0 1 0
7.0406 7.0219 .0188 1 0 1
5.1704 5.1666 .0038 1 -1 1
4.8903 4.8891 .0011 -1 -1 1
4.7904 4.7925 -.0022 -1 1 0
3.6402 3.6378 .0025 -1 -2 1
3.5803 3.5793 .0010 -1 1 1
3.5102 3.5109 -.0007 2 0 2
3.3402 3.3410 -.0008 0 -2 2
3.2902 3.2901 .0001 0 1 2
3.2302 3.2313 -.0010 -2 -1 1
A= 8.28 DA= .01
B= 8.075 DB= .008
C= 9.201 DC= .005
GAMMA= 79.89 DGAMMA= .01
BETA = 72.26 DBETA = .06
ALPHA=102.64 DALPHA= .04
V=552.6
21-1360
Na2Fe{SO4}2
Triklin
Dexp Dcal d(D) h k l
6.4103 6.4063 .0040 2 0 0
5.7405 5.7360 .0045 -1 2 0
4.0002 4.0014 -.0012 -2 1 1
3.9104 3.9102 .0001 0 3 0
3.6403 3.6401 .0002 -2 3 0
3.5702 3.5659 .0043 1 3 0
3.4303 3.4304 -.0001 -3 1 1
3.1903 3.1913 -.0010 3 2 0
3.1002 3.0999 .0003 2 3 0
2.9703 2.9712 -.0010 2 -2 1
2.9302 2.9327 -.0025 0 4 0
2.8902 2.8905 -.0003 -4 1 1
A= 13.239 DA= .001
B= 12.0301 DB= .0006
C= 4.5448 DC= .0004
GAMMA=101.46 DGAMMA= .01
BETA =100.37 DBETA = .01
ALPHA= 82.37 DALPHA= .01
V=695.3
21-1361
Na2Fe{SO4}2*H2O
Triklin
Dexp Dcal d(D) h k l
7.5508 7.5580 -.0072 0 1 1
6.6007 6.6023 -.0016 0 -1 1
6.3206 6.3300 -.0094 1 1 1
5.2705 5.2710 -.0006 1 -1 1
4.7903 4.8001 -.0098 1 0 2
4.5704 4.5815 -.0111 1 2 1
3.7903 3.7875 .0028 1 -2 1
3.4202 3.4224 -.0022 2 1 0
3.2802 3.2777 .0025 2 2 1
3.0902 3.0900 .0002 2 -1 2
2.9502 2.9494 .0009 0 -1 3
2.9102 2.9096 .0007 2 0 3
A= 7.545 DA= .004
B= 10.5410 DB= .0007
C= 10.39820 DC= .00241
GAMMA= 80.919 DGAMMA= .007
BETA = 68.901 DBETA = .006
ALPHA= 79.580 DALPHA= .009
V= 754.86
21-1598
C22H18CuFe2O4
Triklin
Dexp Dcal d(D) h k l
6.8906 6.8904 .0002 1 0 0
5.5902 5.5938 -.0035 0 1 0
3.4602 3.4597 .0004 -1 -1 1
2.7202 2.7205 -.0004 -1 -2 1
2.6702 2.6720 -.0017 0 1 1
2.5802 2.5811 -.0010 1 1 1
2.4402 2.4403 -.0001 2 0 1
2.2502 2.2501 .0001 2 -1 1
2.1402 2.1408 -.0007 -3 -1 1
2.0702 2.0694 .0008 3 2 0
1.5801 1.5801 .0000 -2 2 1
1.5701 1.5701 -.0000 -3 -2 2
1.5201 1.5199 .0002 -1 1 2
1.4701 1.4702 -.0001 2 3 1
A= 7.215 DA= .001
B= 6.145 DB= .001
C= 3.7957 DC= .0003
GAMMA= 72.870 DGAMMA= .008
BETA = 97.42 DBETA = .02
ALPHA=109.05 DALPHA= .02
V= 151.9
21-1694
C12H12FeN2S2
Monoklin
Grupa 7,13
Dexp Dcal d(D) h k l
4.4904 4.4893 .0011 2 1 0
3.9203 3.9207 -.0004 0 3 0
3.6603 3.6601 .0001 0 3 1
3.2102 3.2096 .0006 2 1 2
3.0802 3.0804 -.0002 -3 1 1
2.9402 2.9405 -.0003 0 4 0
2.5702 2.5701 .0001 0 3 3
2.4102 2.4100 .0002 2 4 1
2.0801 2.0803 -.0002 3 2 3
1.7901 1.7901 .0000 4 2 3
a= 9.776 b= 11.762 c= 10.275 beta= 96.461
da=.001 db=.002 dc=.001 dbet=.009
V= 1174.0
Triklin
Dexp Dcal d(D) h k l
4.4904 4.4907 -.0003 1 1 0
3.9203 3.9189 .0013 -1 0 1
3.6603 3.6605 -.0002 -1 -1 1
3.2102 3.2105 -.0002 1 1 1
3.0802 3.0806 -.0004 1 0 1
2.9402 2.9402 -.0000 -1 1 0
2.5702 2.5700 .0002 -1 -2 1
2.4102 2.4102 .0000 -1 -1 2
2.0801 2.0800 .0001 2 1 1
1.7901 1.7901 .0000 0 3 1
A= 5.0539 DA= .0001
B= 5.97388 DB= .00002
C= 5.4130 DC= .0002
GAMMA= 66.997 DGAMMA= .001
BETA =101.905 DBETA = .006
ALPHA= 88.017 DALPHA= .003
V= 145.98
21-1695
C84H60FeN6P3S6
Triklin
Dexp Dcal d(D) h k l
11.7004 11.7124 -.0120 1 0 0
10.9004 10.8283 .0721 -1 1 1
10.1006 10.0883 .0123 -1 0 1
9.4304 9.4225 .0080 -1 1 0
7.8404 7.8145 .0260 1 1 0
7.4004 7.4201 -.0197 0 1 2
7.0106 7.0201 -.0095 -1 2 1
6.5304 6.5304 -.0000 -1 0 2
6.0506 6.0622 -.0116 0 2 2
5.7206 5.7188 .0018 -2 1 0
5.4204 5.4214 -.0010 1 1 2
5.1605 5.1611 -.0006 -1 2 3
A= 12.773 DA= .001
B= 14.587 DB= .003
C= 16.012 DC= .002
GAMMA=109.3203 DGAMMA= .0001
BETA =111.0858 DBETA = .0004
ALPHA= 59.696 DALPHA= .007
V=2361.5
21-1696
C60H40FeN6P2S6
Triklin
Dexp Dcal d(D) h k l
9.0305 9.0626 -.0321 0 1 1
8.2905 8.2963 -.0058 0 -1 1
7.7304 7.7322 -.0017 1 -1 1
7.1807 7.2032 -.0225 0 0 2
6.7707 6.7640 .0067 1 0 2
6.2706 6.2679 .0027 0 1 2
5.8905 5.8858 .0046 1 -1 2
5.6405 5.6373 .0033 -1 -1 1
5.4105 5.4124 -.0019 0 2 0
5.1205 5.1214 -.0009 -1 1 2
4.8503 4.8532 -.0028 1 0 3
4.4503 4.4528 -.0025 1 2 1
A= 10.794 DA= .001
B= 11.091 DB= .001
C= 14.9188 DC= .0004
GAMMA=101.458 DGAMMA= .006
BETA = 75.875 DBETA = .008
ALPHA= 87.787 DALPHA= .001
V=1690.3
21-1697
C22H20FeN6S2
Triklin
Dexp Dcal d(D) h k l
9.0409 9.0602 -.0193 0 1 1
8.3006 8.3044 -.0038 0 -1 1
7.1397 7.1328 .0069 -1 1 0
6.8404 6.8270 .0134 1 -1 1
6.4906 6.4920 -.0015 1 1 0
5.9004 5.8838 .0167 0 3 0
5.3203 5.3156 .0047 1 2 0
5.0004 4.9983 .0021 1 0 2
4.8304 4.8250 .0054 1 1 2
4.4404 4.4439 -.0035 1 3 1
4.3703 4.3727 -.0024 1 2 2
4.0302 4.0261 .0041 -1 4 0
A= 7.8851 DA= .0001
B= 17.840 DB= .001
C= 10.6111 DC= .0007
GAMMA= 95.97 DGAMMA= .01
BETA = 70.246 DBETA = .009
ALPHA= 86.56 DALPHA= .01
V=1391