1. 35-0041
V{H2PO3}3
Geks.
Groupa 158,165,173,176,
Dexp. Dcal. d(D) h k l
7.1000 7.1426 -.0426 1 0 0
4.9700 4.9813 -.0113 1 0 1
3.5500 3.5465 .0035 1 1 1
3.4700 3.4753 -.0053 0 0 2
3.1800 3.1765 .0035 2 0 1
2.7000 2.6996 .0004 2 1 0
2.6600 2.6574 .0026 1 1 2
2.5200 2.5165 .0035 2 1 1
2.4910 2.4906 .0004 2 0 2
2.3780 2.3809 -.0029 3 0 0
2.2530 2.2524 .0006 3 0 1
2.1280 2.1320 -.0040 2 1 2
2.0210 2.0199 .0011 1 1 3
1.9830 1.9810 .0020 3 1 0
a= 8.25 c= 6.9505
da=.01 dc= .0007
V= 409.4
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
7.1000 7.1426 -.0426 1 0 0
4.9700 4.9806 -.0106 1 1 0
3.5500 3.5529 -.0029 -1 1 2
3.4700 3.4743 -.0043 0 2 0
3.1800 3.1763 .0037 2 1 0
2.7000 2.7031 -.0031 -2 0 3
2.6600 2.6598 .0002 -1 2 2
2.5200 2.5192 .0008 -2 1 3
2.4910 2.4903 .0007 2 2 0
2.3780 2.3789 -.0009 -3 0 3
2.2530 2.2523 .0007 3 1 0
2.1280 2.1295 -.0015 -3 2 1
2.0210 2.0211 -.0001 1 3 1
1.9830 1.9828 .0002 2 1 2
a= 8.230 b= 6.949 c=8.27 beta=119.79
da=.009 db=.003 dc=.02 dbet=.07
V=408.4
Triklin
Dexp Dcal d(D) h k l
7.1000 7.0996 .0004 -1 0 1
4.9700 4.9811 -.0111 1 1 0
3.5500 3.5498 .0002 -2 0 2
3.4700 3.4693 .0007 0 -1 2
3.1800 3.1804 -.0004 0 2 0
2.7000 2.7000 .0000 0 2 2
2.6600 2.6602 -.0002 -2 1 3
2.5200 2.5201 -.0001 -3 1 1
2.4910 2.4905 .0005 2 2 0
2.3780 2.3779 .0001 -3 1 0
2.2530 2.2530 .0000 -1 1 4
2.1280 2.1279 .0001 -1 -2 3
2.0210 2.0211 -.0001 0 -1 4
1.9830 1.9829 .0001 -3 1 4
A= 8.2283 DA= .0006
B= 6.389 DB= .001
C= 9.35777 DC= .00004
GAMMA= 90.4028 DGAMMA= .0001
BETA =109.23 DBETA = .01
ALPHA= 84.81 DALPHA= .01
V= 462.47
2. 35-0042
V{H2PO3}3
Tetrag
Groupa 85,118,129
Dexp. Dcal. d(D) h k l
6.7000 6.7185 -.0185 1 1 0
4.9000 4.8896 .0104 0 0 1
3.4000 3.4073 -.0073 2 0 1
2.6600 2.6582 .0018 3 0 1
a= 9.50 c= 4.89
da= .05 dc= .01
v= 441
3. 35-0085
InVO4
Triklin
Dexp Dcal d(D) h k l
6.7900 6.7923 -.0023 1 1 1
5.2300 5.2319 -.0019 -1 1 0
4.6200 4.6170 .0030 1 -1 1
4.4200 4.4202 -.0002 -1 1 1
3.4200 3.4195 .0005 1 2 2
3.2800 3.2806 -.0006 -1 -1 2
3.2200 3.2171 .0029 -2 1 1
3.1300 3.1309 -.0009 3 0 2
2.8500 2.8490 .0010 -3 -1 1
2.7500 2.7492 .0008 1 2 3
2.6560 2.6560 .0000 3 2 3
2.5590 2.5596 -.0006 2 3 2
A= 11.092 DA= .002
B= 8.029 DB= .001
C= 9.692 DC= .004
GAMMA= 68.91 DGAMMA= .01
BETA = 68.91 DBETA = .02
ALPHA= 74.90 DALPHA= .01
V= 742.8
4. 35-0130
TlMoV2O10
Triklin
Dexp Dcal d(D) h k l
6.6900 6.6932 -.0032 0 -1 1
6.0700 6.0711 -.0011 -1 0 1
4.2100 4.2111 -.0011 0 -3 1
3.7100 3.7094 .0006 -1 0 2
3.5000 3.5006 -.0006 -2 1 1
3.3800 3.3802 -.0002 1 -3 1
3.2600 3.2593 .0007 2 1 0
3.1900 3.1918 -.0018 -2 -2 1
3.0700 3.0696 .0004 1 4 0
2.8490 2.8485 .0005 -2 -3 1
2.6100 2.6098 .0002 -2 -3 2
2.5470 2.5469 .0001 1 -3 2
A= 7.2707 DA= .0009
B= 14.424 DB= .002
C= 7.589 DC= .001
GAMMA= 92.01 DGAMMA= .02
BETA =109.90 DBETA = .02
ALPHA= 96.248 DALPHA= .002
V= 741.7
5. 35-0281
CrFe{VO4}2
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
3.2500 3.2526 -.0026 1 0 1
3.0500 3.0442 .0058 1 1 1
2.7000 2.7019 -.0019 2 0 1
2.6000 2.5987 .0013 1 2 1
2.3500 2.3509 -.0009 3 2 0
2.2300 2.2312 -.0012 0 3 1
2.1600 2.1605 -.0005 0 4 0
2.0100 2.0085 .0015 3 3 0
1.6500 1.6502 -.0002 5 1 0
a= 8.405 b= 8.642 c= 3.527
da= .002 db= .003 dc= .001
v= 256.2
6. 35-0309
Li2V2WO9
Triklin
Dexp Dcal d(D) h k l
6.1100 6.1092 .0008 -2 1 0
4.2700 4.2717 -.0017 3 0 0
3.3260 3.3261 -.0001 1 1 1
3.1210 3.1208 .0002 -2 1 1
3.0810 3.0803 .0007 -2 3 0
3.0090 3.0079 .0011 -2 0 1
2.7610 2.7616 -.0006 -3 1 1
2.4330 2.4332 -.0002 -1 -2 1
2.3470 2.3469 .0001 -2 4 0
2.3190 2.3188 .0002 4 2 0
2.2550 2.2553 -.0003 0 4 0
2.1860 2.1860 -.0000 -6 2 0
A= 13.3712 DA= .0004
B= 9.5204 DB= .0006
C= 3.5778 DC= .0003
GAMMA=106.162 DGAMMA= .005
BETA = 88.82 DBETA = .01
ALPHA= 81.29 DALPHA= .02
V=431.4
7. 35-0332
V0.87Cr0.13O2.17
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
5.6000 5.6027 -.0027 -1 1 1
4.7900 4.7863 .0037 1 2 0
4.0200 4.0207 -.0007 1 1 1
3.3600 3.3611 -.0011 -1 1 2
2.8500 2.8498 .0002 0 2 2
2.7300 2.7298 .0002 0 4 1
2.5800 2.5800 .0000 -3 0 2
2.1300 2.1297 .0003 3 1 1
1.9800 1.9803 -.0003 3 4 0
1.9000 1.8999 .0001 0 3 3
1.8500 1.8500 .0000 -4 0 3
a= 8.537 b=12.0437 c=7.0033 beta= 112.499
da=.004 db=.0003 dc=.0008 dbet=.006
V= 665.2
Triklin
Dexp Dcal d(D) h k l
5.6000 5.6062 -.0062 1 0 0
4.7900 4.7859 .0041 1 1 1
4.2900 4.2881 .0019 -1 -1 1
4.0200 4.0186 .0014 0 0 2
3.3600 3.3598 .0002 -1 0 2
2.8500 2.8499 .0001 2 1 1
2.7300 2.7302 -.0002 2 2 0
2.5800 2.5812 -.0012 -1 2 0
2.1300 2.1299 .0001 -2 1 2
1.9800 1.9800 -.0000 -1 -2 3
1.9000 1.8996 .0004 -2 2 1
1.8500 1.8499 .0001 2 4 1
A= 6.0246 DA= .0009
B= 7.7286 DB= .0005
C= 8.24946 DC= .00001
GAMMA= 68.77 DGAMMA= .03
BETA = 88.50 DBETA = .02
ALPHA= 77.40 DALPHA= .02
V= 348.8
8. 35-0333
V0.87Fe9.13O2.17
Rombik
Groupa 16
Dexp. Dcal. d(D) h k l
5.0100 5.0028 .0072 1 0 2
4.3900 4.4050 -.0150 3 0 0
3.5200 3.5145 .0055 0 1 0
3.3400 3.3423 -.0023 0 1 1
2.9800 2.9825 -.0025 2 1 1
2.6900 2.6910 -.0010 2 1 2
2.5000 2.5014 -.0014 2 0 4
2.0000 2.0016 -.0016 4 1 3
1.8400 1.8391 .0009 6 1 1
1.7200 1.7198 .0002 1 2 1
1.7000 1.6990 .0010 3 1 5
1.6100 1.6085 .0015 4 1 5
1.5900 1.5896 .0004 7 1 2
1.5500 1.5515 -.0015 4 2 0
a=13.215 b= 3.5145 c=10.81
da= .001 db= .0005 dc= .01
V= 502.1
9. 35-0334
V0.87Mo0.13O2.17
Rombik
Groupa 26,28,51
Dexp. Dcal. d(D) h k l
4.6900 4.6245 .0655 2 0 1
3.8600 3.8588 .0012 0 1 0
3.1700 3.1801 -.0101 3 0 1
2.6800 2.6786 .0014 3 0 3
2.4100 2.4122 -.0022 4 0 1
2.1300 2.1303 -.0003 3 0 5
2.0100 2.0090 .0010 4 0 4
1.8600 1.8606 -.0006 0 2 2
1.6500 1.6495 .0005 3 2 1
1.5900 1.5900 -.0000 6 0 2
1.5200 1.5201 -.0001 2 1 8
1.4300 1.4300 -.0000 3 2 5
a= 9.794 b= 3.8588 c=14.056
da= .002 db= .0001 dc= .006
V= 531.2
10. 35-0336
KV{PO3}4
Triklin
Dexp Dcal d(D) h k l
8.4100 8.3515 .0585 0 1 1
6.1500 6.1406 .0094 0 -1 1
5.9900 5.9980 -.0080 -1 1 0
5.0900 5.0876 .0024 1 1 0
5.0300 5.0345 -.0045 1 -1 1
4.8300 4.8280 .0020 -1 1 1
4.8000 4.7933 .0067 -1 2 0
4.3600 4.3629 -.0029 -1 2 1
4.3200 4.3226 -.0026 0 0 2
3.9690 3.9703 -.0013 0 3 0
3.9520 3.9511 .0009 1 0 2
3.9410 3.9423 -.0013 1 1 2
A= 6.3882 DA= .0005
B= 12.6765 DB= .0005
C= 9.219 DC= .001
GAMMA= 98.305 DGAMMA= .009
BETA = 80.962 DBETA = .003
ALPHA= 73.52 DALPHA= .01
V=693.2
11. 35-0336
KV{PO3}4
Triklin
Dexp Dcal d(D) h k l
8.4100 8.3515 .0585 0 1 1
6.1500 6.1406 .0094 0 -1 1
5.9900 5.9980 -.0080 -1 1 0
5.0900 5.0876 .0024 1 1 0
5.0300 5.0345 -.0045 1 -1 1
4.8300 4.8280 .0020 -1 1 1
4.8000 4.7933 .0067 -1 2 0
4.3600 4.3629 -.0029 -1 2 1
4.3200 4.3226 -.0026 0 0 2
3.9690 3.9703 -.0013 0 3 0
3.9520 3.9511 .0009 1 0 2
3.9410 3.9423 -.0013 1 1 2
A= 6.3882 DA= .0005
B= 12.6765 DB= .0005
C= 9.219 DC= .001
GAMMA= 98.305 DGAMMA= .009
BETA = 80.962 DBETA = .003
ALPHA= 73.52 DALPHA= .01
V=693.2
12. 35-0337
KVP2O7
Triklin
Dexp Dcal d(D) h k l
7.0500 7.0534 -.0034 1 0 0
5.7800 5.7718 .0082 -1 1 0
5.2800 5.2799 .0001 0 -1 1
3.9170 3.9159 .0011 2 -1 1
3.6540 3.6506 .0034 0 -1 2
3.5260 3.5267 -.0007 2 0 0
3.4010 3.4048 -.0038 1 -2 1
3.0830 3.0841 -.0011 0 -2 1
3.0260 3.0271 -.0011 -1 1 2
2.9440 2.9464 -.0024 -2 1 1
2.8850 2.8859 -.0009 -2 2 0
2.8630 2.8647 -.0017 2 -1 3
A= 8.080 DA= .001
B= 6.9674 DB= .0006
C= 9.44 DC= .01
GAMMA=110.07 DGAMMA= .09
BETA = 66.674 DBETA = .005
ALPHA= 98.97 DALPHA= .09
V= 458.1
13. 35-0338
CsVHP3O10
Triklin
Dexp Dcal d(D) h k l
6.1500 6.1379 .0121 1 0 0
4.9900 5.0049 -.0149 1 1 1
4.4200 4.4158 .0042 -1 -1 1
4.3300 4.3252 .0048 1 0 2
4.2600 4.2624 -.0024 1 -1 1
3.7500 3.7501 -.0001 -1 1 1
3.5400 3.5438 -.0038 1 2 0
3.4300 3.4244 .0056 1 2 1
3.1000 3.1014 -.0014 2 1 1
3.0700 3.0689 .0011 2 0 0
3.0200 3.0205 -.0005 -1 1 2
2.9800 2.9805 -.0005 0 1 3
A= 6.402 DA= .003
B= 7.688 DB= .001
C= 10.147 DC= .007
GAMMA= 78.63 DGAMMA= .07
BETA = 78.21 DBETA = .04
ALPHA= 90.11 DALPHA= .07
V=479.4
14. 35-0359
Mg2P6{VO4}2
Triklin
Dexp Dcal d(D) h k l
4.3700 4.3700 -.0000 1 -1 0
3.8200 3.8200 .0000 1 1 2
3.5000 3.4995 .0005 1 -1 3
3.4300 3.4307 -.0007 -2 0 1
3.1100 3.1076 .0024 2 0 2
2.8700 2.8700 .0000 2 0 3
2.8200 2.8199 .0001 0 -2 1
2.7700 2.7699 .0001 1 -1 5
2.5180 2.5166 .0014 1 -2 2
2.4040 2.4052 -.0012 1 -2 3
2.1810 2.1804 .0006 -2 2 1
2.1030 2.1030 .0000 -3 1 2
A= 6.8841 DA= .0002
B= 5.6807 DB= .0001
C= 18.63 DC= .01
GAMMA= 89.799 DGAMMA= .004
BETA = 95.98 DBETA = .03
ALPHA= 91.89 DALPHA= .04
V= 724.2
15. 35-0434
Cs2V6O16
Triklin
Dexp Dcal d(D) h k l
8.1920 8.2129 -.0209 1 0 0
5.8820 5.8746 .0074 0 -1 1
4.9950 4.9992 -.0042 -1 0 1
4.2910 4.2832 .0078 2 -1 1
4.0830 4.0868 -.0038 -1 2 0
3.6790 3.6839 -.0049 2 0 1
3.3350 3.3344 .0006 -2 1 1
3.2630 3.2622 .0008 1 0 2
3.2100 3.2114 -.0014 1 -2 2
3.1040 3.1042 -.0002 2 1 0
3.0480 3.0476 .0004 2 -2 2
2.9760 2.9747 .0013 1 2 0
A= 9.261 DA= .003
B= 8.701 DB= .003
C= 7.2730 DC= .0004
GAMMA=116.966 DGAMMA= .007
BETA = 76.22 DBETA = .02
ALPHA=109.86 DALPHA= .02
V=488.6
16. 35-0435
Rb2V6O16
Triklin
Dexp Dcal d(D) h k l
7.8600 7.8500 .0100 1 0 0
5.7550 5.7541 .0009 1 0 1
4.2350 4.2357 -.0007 -1 -2 1
4.0350 4.0351 -.0001 1 2 0
3.9590 3.9591 -.0001 0 0 2
3.7390 3.7413 -.0023 2 1 0
3.5480 3.5457 .0023 -2 -1 1
3.2210 3.2189 .0021 0 -3 1
3.0290 3.0295 -.0005 0 -3 2
2.9370 2.9365 .0005 0 3 0
2.8910 2.8915 -.0005 -1 -3 2
2.8440 2.8439 .0001 -1 1 2
A= 7.899 DA= .004
B= 9.708 DB= .007
C= 8.690 DC= .001
GAMMA= 84.67 DGAMMA= .05
BETA = 88.984 DBETA = .002
ALPHA=114.09 DALPHA= .01
V= 604.6
17. 35-0436
NaV3O8
Triklin
Dexp Dcal d(D) h k l
9.6480 9.6328 .0152 0 2 0
6.9640 6.9625 .0015 1 2 0
5.7980 5.7949 .0031 0 0 1
5.3360 5.3420 -.0060 2 0 0
4.9970 4.9950 .0020 -1 1 1
4.7840 4.7835 .0005 0 2 1
4.6870 4.6863 .0007 1 1 1
4.0670 4.0670 -.0000 -2 0 1
3.8540 3.8531 .0009 0 5 0
3.6420 3.6429 -.0009 1 -4 1
3.4580 3.4591 -.0011 -1 4 1
3.1920 3.1914 .0006 -3 3 0
A= 10.7221 DA= .0001
B= 19.3649 DB= .0001
C= 5.82890 DC= .00001
GAMMA= 92.903 DGAMMA= .001
BETA = 93.6172 DBETA = .0002
ALPHA= 94.84551 DALPHA= .00006
V=1202.3
18. 35-0437
LiV3O8
Triklin
Dexp. Dcal. d(D) h k l
16.6590 16.6590 .0000 0 1 0
11.7770 11.7770 .0000 1 -1 0
8.7090 8.7027 .0063 0 0 1
6.3670 6.3670 .0000 2 0 0
5.6850 5.6874 -.0024 1 -3 0
4.3830 4.3838 -.0008 -2 2 1
4.0710 4.0731 -.0021 0 -4 1
3.8020 3.7994 .0026 2 -3 2
3.4240 3.4244 -.0004 -3 -2 0
3.2360 3.2360 -.0000 1 4 1
3.1830 3.1835 -.0005 4 0 0
3.1170 3.1189 -.0019 -2 -4 0
A= 13.4849 DA= .0003
B= 17.82 DB= .01
C= 9.037 DC= .007
GAMMA=107.75 DGAMMA= .02
BETA = 78.87 DBETA = .03
ALPHA=103.78 DALPHA= .03
V= 1992
19. 35-0860
KVSO6*3H2O
Triklin
Dexp Dcal d(D) h k l
6.2200 6.2214 -.0014 0 1 1
5.2500 5.2582 -.0082 0 -1 1
5.1000 5.1015 -.0015 1 1 0
4.9000 4.8955 .0045 1 0 1
3.8540 3.8530 .0010 1 -2 1
3.7860 3.7836 .0024 -1 2 1
3.5310 3.5305 .0005 -1 -1 1
3.1590 3.1586 .0004 0 0 2
3.1100 3.1107 -.0007 0 2 2
3.0590 3.0596 -.0006 -1 4 0
3.0080 3.0089 -.0009 -2 1 0
2.9760 2.9750 .0010 2 0 0
A= 6.1428 DA= .0006
B= 13.37 DB= .04
C= 6.583 DC= .003
GAMMA= 97.07 DGAMMA= .04
BETA = 79.063 DBETA = .009
ALPHA= 79.47 DALPHA= .02
V=513.3
20. 35-0861
KVSO6
Rombik
Groupa 26,28,51
Dexp. Dcal. d(D) h k l
6.6000 6.6020 -.0020 1 0 1
4.8700 4.8929 -.0229 1 1 0
3.8470 3.8555 -.0085 1 0 2
3.5090 3.5126 -.0036 2 1 1
3.3610 3.3658 -.0048 3 0 1
3.2830 3.2842 -.0012 0 1 2
3.1510 3.1485 .0025 1 1 2
2.8610 2.8644 -.0034 3 1 1
2.7250 2.7275 -.0025 0 2 0
2.6200 2.6222 -.0022 4 0 1
2.4560 2.4569 -.0009 2 0 3
2.2960 2.2956 .0004 4 0 2
a=11.066 b= 5.455 c= 8.226
da= .004 db= .002 dc= .005
V= 496.6
Triklin
Dexp Dcal d(D) h k l
6.6000 6.5969 .0031 0 1 0
4.8700 4.8766 -.0066 -1 -1 1
3.8470 3.8454 .0016 0 -1 2
3.5090 3.5092 -.0002 1 2 0
3.3610 3.3590 .0020 2 1 1
3.2830 3.2837 -.0007 -1 -2 1
3.1510 3.1497 .0013 0 -2 1
2.8610 2.8621 -.0011 1 0 3
2.7250 2.7235 .0015 0 1 3
2.6200 2.6201 -.0001 0 2 2
2.4560 2.4565 -.0005 -1 2 1
2.2960 2.2963 -.0003 1 2 3
A= 7.1419 DA= .0003
B= 7.089 DB= .002
C= 9.190 DC= .007
GAMMA= 68.678 DGAMMA= .006
BETA = 86.07 DBETA = .09
ALPHA= 91.02 DALPHA= .05
V=432.1
21. 35-0862
k4V2S4O19
Triklin
Dexp Dcal d(D) h k l
6.8300 6.8300 .0000 -1 -1 1
5.5600 5.5533 .0067 -1 1 0
5.1400 5.1437 -.0037 -1 -1 2
4.5800 4.5782 .0018 1 1 1
4.0500 4.0480 .0020 -1 1 2
3.8210 3.8197 .0013 -2 0 1
3.7140 3.7147 -.0007 -1 2 1
3.6360 3.6370 -.0010 1 2 1
3.5310 3.5305 .0005 -1 -3 1
3.3430 3.3446 -.0016 -2 1 1
3.2590 3.2586 .0004 -2 1 0
3.0970 3.0968 .0002 -2 1 2
A= 7.851 DA= .001
B= 10.893 DB= .005
C= 11.119 DC= .003
GAMMA= 76.73 DGAMMA= .04
BETA =112.133 DBETA = .008
ALPHA=105.67 DALPHA= .01
V=839.6
22. 35-0863
K3VS2O13
Triklin
Dexp Dcal d(D) h k l
6.4400 6.4412 -.0012 -2 1 0
6.2600 6.2602 -.0002 2 0 0
5.6300 5.6298 .0002 1 -1 1
5.2300 5.2268 .0032 -1 2 0
4.6300 4.6267 .0033 1 -2 1
4.3800 4.3819 -.0019 0 -2 1
4.1700 4.1735 -.0035 3 0 0
4.0700 4.0647 .0053 1 2 0
3.9660 3.9616 .0044 -3 2 0
3.6690 3.6696 -.0006 3 -2 1
3.4370 3.4390 -.0020 -2 3 0
3.2450 3.2458 -.0008 0 3 0
A= 13.528 DA= .003
B= 10.996 DB= .002
C= 5.983 DC= .001
GAMMA=112.26 DGAMMA= .01
BETA = 83.674 DBETA = .008
ALPHA=108.019 DALPHA= .001
V=783.6
23. 35-0988
Na3Pr{VO3}{SO4}4
Triklin
Dexp Dcal d(D) h k l
4.7720 4.7777 -.0057 0 0 3
4.6370 4.6374 -.0004 -1 0 1
3.8930 3.8933 -.0003 0 -1 2
3.5840 3.5832 .0008 0 0 4
2.8360 2.8364 -.0004 0 -1 4
2.6660 2.6657 .0003 1 1 4
2.5210 2.5206 .0004 1 2 0
2.3580 2.3589 -.0009 -2 -1 3
2.3140 2.3141 -.0001 1 1 5
2.2180 2.2178 .0002 2 0 2
2.2030 2.2030 .0000 -1 0 6
1.9440 1.9441 -.0001 0 2 4
A= 5.238 DA= .001
B= 5.06439 DB= .00009
C= 14.3809 DC= .0007
GAMMA= 66.185 DGAMMA= .007
BETA = 94.69 DBETA = .01
ALPHA= 91.97 DALPHA= .01
V= 347.8
24. 35-1750
CH3Cl2V
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.3500 8.3388 .0112 0 1 1
7.4400 7.4379 .0021 0 2 0
6.6000 6.5924 .0076 1 1 0
5.1400 5.1423 -.0023 1 1 1
4.7700 4.7691 .0009 0 1 2
2.9750 2.9752 -.0002 0 5 0
2.6150 2.6150 .0000 -2 4 1
2.4550 2.4549 .0001 -2 4 2
2.2810 2.2810 -.0000 -2 0 4
a= 7.480 b= 14.876 c= 10.243 beta=100.5
da=.003 db=.009 dc=.05 dbeta=.2
V= 1120
25. 35-1752
C6H15O3V
Triklin
Dexp Dcal d(D) h k l
8.5100 8.5115 -.0015 0 1 0
5.3100 5.3090 .0010 -1 0 1
5.1000 5.0926 .0074 0 -1 2
4.7700 4.7748 -.0048 1 0 1
4.5800 4.5820 -.0020 -1 1 1
4.4000 4.3993 .0007 1 1 0
4.1500 4.1507 -.0007 -1 0 2
3.8000 3.8056 -.0056 0 -2 2
3.6800 3.6778 .0022 1 -2 1
2.4100 2.4098 .0002 -1 2 3
3.1860 3.1871 -.0011 -1 0 3
3.0780 3.0767 .0013 -1 -2 2
2.9780 2.9784 -.0004 0 2 2
A= 5.81192 DA= .00003
B= 8.878 DB= .007
C= 10.9672 DC= .0002
GAMMA= 98.469 DGAMMA= .001
BETA = 95.059 DBETA = .002
ALPHA=103.27 DALPHA= .09
V= 540.4