'Input file for Simple Rietveld or Pawley refinement
r_wp  13.0913765 r_exp  10.8487919 r_p  8.44178353 weighted_Durbin_Watson  1.4802614 gof  1.20671284
iters 1000
chi2_convergence_criteria 0.001

xdd d5_05005.RAW
	x_calculation_step = Yobs_dx_at(Xo); convolution_step 4
	bkg @  26.2697718` -19.9723063`  7.99401098` -2.61184453`  0.89547755`  0.901217055`
	Simple_Axial_Model(axial, 9.25089675`)
	'Bragg Brentano  Cu Ka1/a2 graphite diffracted beam mono scint analytical peak shape
	LP_Factor(!th2_monochromator, 26.6)
	CuKa2_analyt(0.0001)
	Specimen_Displacement(height,-0.0719062345`)

	hkl_Is
		phase_name tio2_pawley
		TCHZ_Peak_Type(pku, 0.00666567944`,pkv, -0.00967304773`,pkw,  0.00301493601`,!pkz, 0.0000,pkx, 0.0477054602`,pky, 0.0630384406`)
		a lpa  4.593279`
		b lpa  4.593279`
		c lpc  2.957944`
		al 90
		be 90
		ga 90
		space_group P42/mnm
		load hkl_m_d_th2 I 
		{
			    1    1    0    4     3.247939       27.43861     @  51.3364321`
			    1    0    1    8     2.486897       36.08749     @  36.9770175`
			    2    0    0    4     2.296640       39.19405     @  6.41054764`
			    1    1    1    8     2.186934       41.24729     @  24.0267649`
			    2    1    0    8     2.054177       44.04758     @  10.6724304`
			    2    1    1   16     1.687226       54.32910     @  124.530617`
			    2    2    0    4     1.623969       56.63160     @  41.8730507`
			    0    0    2    2     1.478972       62.77643     @  22.7183521`
			    3    1    0    8     1.452522       64.05391     @  25.8330412`
			    2    2    1    8     1.423537       65.51933     @  2.33443772`
			    3    0    1    8     1.359733       69.01407     @  74.5085728`
			    1    1    2    8     1.345995       69.82010     @  35.1259053`
			    3    1    1   16     1.303805       72.42877     @  4.26051062`
			    3    2    0    8     1.273946       74.40814     @  0.827789512`
			    2    0    2    8     1.243448       76.55723     @  9.19844049`
			    2    1    2   16     1.200246       79.84996     @  5.09458991`
			    3    2    1   16     1.170044       82.34841     @  21.5841325`
			    4    0    0    4     1.148320       84.25850     @  15.2727252`
			    4    1    0    8     1.114034       87.49004     @  5.45258126`
			    2    2    2    8     1.093467       89.57119     @  38.8194902`
		}