h k l

dexp/nm

dcalc/nm

I/I0

h k l

dexp/nm

dcalc/nm

I/I0

1 0 0

12.479

12.47

7.2

3 4 2

2.831

2.833

2.4

1 1 0

9.907

9.939

100.0

4 0 −4

2.788

2.79

18.4

0 2 0

8.247

8.23

26.7

1 6 0

2.681

2.679

16.5

0 1 3

7.236

7.216

2.7

4 3 2

2.635

2.635

3.2

1 0 −3

6.817

6.81

14.7

3 1 7

2.593

2.593

2.8

2 0 0

6.232

6.235

4.3

4 4 1

2.469

2.468

4.0

1 2 −2

5.98

5.994

1.4

2 4 7

2.42

2.418

4.7

2 1 −1

5.684

5.69

3.2

3 1 8

2.391

2.391

2.4

2 0 −2

5.577

5.581

4.6

3 3 7

2.368

2.369

2.5

1 0 4

5.369

5.382

6.9

1 7 −1

2.301

2.301

2.6

2 2 0

4.962

4.97

5.4

1 7 −2

2.272

2.271

2.0

0 0 5

4.808

4.817

6.8

3 6 −2

2.254

2.254

3.1

2 2 2

4.579

4.569

16.5

3 4 7

2.215

2.214

3.5

1 1 −5

4.367

4.361

12.4

2 7 −2

2.166

2.167

3.3

3 0 0

4.157

4.157

2.7

4 1 8

2.128

2.127

1.5

0 0 6

4.004

4.014

17.8

6 1 0

2.063

2.062

1.4