MZ@ !L!This program cannot be run in DOS mode. $PELz?H  7&@@p.text%& `.data@*@.bssP.idatap2@.stab8R.stabstr  <RU@Dt}fEf%fEfEf ?fEmhp @#] $Id: refer.c,v 1.2 2002/09/11 15:41:01 berar Exp $ t&'xnd_1.28 (Wed Jul 16 17:08:25 2003)U帀@]vU帼@]cygwin(i686-pc-cygwin)'U@]Ít& For docs : http://www-cristallo.grenoble.cnrs.fr/xnd/xnd.html For bugs,... : berar@grenoble.cnrs.fr For updates : ftp://ftp.grenoble.cnrs.fr/pub/xnd (login:anonymous) U@]ÐJ.-F.Berar, G.Baldinozzi, CPD Newsletter 20 (1998), p3-5 U@] $Id: xnd_loop.c,v 1.4 2003/07/16 15:05:55 berar Exp $ exper_loop(xnd_loop.c) %s #%d CYCLE #%d #%d %s %sdif_nature invalideprof_matprof_posdiag_rpro Minimised_Sum = %.7g (powder = %.7g, penal = %.7g, hkl = %.7g) Probable errors on variables = %.2f * sigma Statisticaly, the model may be accepted if : |GoF-1|, |d-2| <~ 3/sqrt(%d)= %.4f }:@&UWVShx@xh`hDh`hD@]DP5@hD5hD5ZD5fD=hD@u@Ph@}gD VD0]DPgD^D(f=YDt5YDM1=dDu=hD@WD1=dDu=hDu=VD`[D1@VD`VD;5gD'5`VDw`VDPbD bD]DVDXDtP_D@$XDt P_D@ h@!|`VD`Dt>h@jCÉP\}p_Dh@j5 _DE}[Dp_D[D1ۋ`VDPVD;M&PVDxuh@j4j|¡PVDP PVD@iDǸ `VD@^DiDgDBgDgDgDgDB gDgDBgDgDBgD hDB, hDhDB(hDgDBgDgDBgDhDB hDgDBgDhDB0hDh0]D.^DCPVD`VD;=[Dt5[Dk=p_Dt5p_DTuF`VD ;5gDa1fDeD;5`fD}H'eDxtPgDPgDFeDd;5`fD|jhgDPgD0]DVDpcDtgD%pcDtVDgD VDgDVD^D+pbDVD@EGd$$h@CyPgD0]D Eu@0]Dd$$PgDd$$VD%PgD%0]Dd$$h@xh@x=hDS$[=VDPhDPgDgD5VDE@t؍d$$]Ed$$h@@5 ^DdS$[E@t؍d$$U=@]Ed~d$$Sh@5 ^D5 ^D{se[^_]powder(xnd_loop.c) R_BRAGG not calculated, impossible to allocate the needed temporary file EXPER '%s' at %.3f PHASE #%d : '%s' %s scale E=%8.3g (%5.3f) Meaningless scale factor Cell volume of this phase is non-positive t&}:&UVSh@qhDPVD`VDؠfD]DfDB `DpVDBdDB@`D5PbDljQmbDjDm`Dj7mXDj*mYD@EWDgDuh @5 ^D=hDu3=gD =WD~!PVDd$$5`VDhk@u5XD5 _DmUVD1pgDZD;5XDt&'ZD@ eDP]pPVDeDآ  hD]D hD=hDu&ZDp RjD@hPh@5 ^D]D`YD_DeDvt^Ejh@jeDBAPu`bDeDjjwkeDjjk\D`bD5eD1ۃ5`bDS eDeDeD;X|҃=`fD~==hDu4`bDeDd$$eDd$$h@5 ^DeD@EuWeDkDu 託IeDu.V5hD_DhDh@5 ^D\5`bDVh@5 ^D95 ^D#ZD8u&eDt^eDtWwnFZDD;5XDs]DfD$0=hDu3=gDt*=dDt tAJ5gDgDCU5 ^D|nPYDe[^] $Id: xnd_main.c,v 1.2 2003/04/10 15:37:29 berar Exp $ HOSTHKL filewPLG file&' Creating %d vars for set %d : n_var = %d, n_par = %d & New Marquardt coefficient = %.3g Overall Overall mt&??UWVSPDhPDjhPDX@]D@PDYD0PD PDkh@d@hD u @hD@u us <+PDPPD _DpbDZD=bD_'{kZD;bDudD=dDu4 _DPj5aD@YDPj5VD=ZDt'=_DtS5aD,5VD!hiD;J=aDth@h@hbDr]D =VDth@h@hdDr0hD hDhD=ZDuVDU]VDUEu]؀=dD+hD PD= _DhD=ZD~VD5 YDd$$j蹥u+hD0PD`pcDu=ZD~VD YDEu F 3t&1; _D}%aDgD _Dt&B9|VD YD=H@Du<=hDPj1= _DthD@P ^ _DE=hDPj1= _DthD@PE1fDeD ;=`fDv'1eD`lD;lD8~`xuZj0jp$rÉ _D _DpbD_D_DeDQRVlD0h@5 ^De(FlD(eD;|GeDd;=`fDJE9 _Dt25 _DTS _D@ _D@YDuH@D5 ^D=[Dt{bDX @Euh=ZDt_VD YDEu[D ` @ bD[D h @=bDbDbDd$$h @5 ^D`ZD@ZD;bD=aDt5]D6]D=VDt50hD0hDhiDhC @5 ^DL =\DthiDhN @FDpL bRPWD@v5@fD5pbDhgD1 =fDtVD YD蔔=bDuh@jVDEE@u14 +hD@PDVD]EuZD;bD|h@R1e[^_]ÍUEtP< 1] XND_ERROR%s %s Duree %lds STOP %d, %s cal_derivmin_liinvertingprintingreadingtotal CPU usage : %9s=%.2fs %9s=%.2fs %9s=%.2fs %9s=%.2fs %9s=%.2fs %9s=%.2fs {Gz?UWS]h`hD G +PDhDh`hD @]D ~ te5@]DS`hD+PDPu &@@Ph '@i PD1RP,$XZ'@ɍd$$h?'@YD1RP,$XZɍd$$hI'@0PD1RP,$XZɍd$$hP'@@PD1RP,$XZɍd$$hZ'@PPD1RP,$XZɍd$$hc'@hD1RP,$XZɍd$$hk'@h'@hdUO50hD0hD5]D]D5gDgD5P]DP]DPQ@^D׹t R ZD׹t R  \Dt=@[Dt =@[Du h \DS 5 ^DM S7  Rwp=%.4f Rp=%.4f Rwp_c=%.4f GoF=%.2f (Rwp_b=%.4f Rp_b=%.4f) %s SwDi2=%.5g SwIo2=%.5g SDi=%.5g SIo=%.5g SwDp_c=%.5g SwDi2_b=%.5g SwIo2_b=%.5g SDi_b=%.5g SIo_b=%.5g N_b=%d Rexp=%.3f d-2=%.2f Ne=%.0f N=%d t&}:@UVS]u *@EC3E@t؍d$$]C3E@t؍d$$i]C s]C*@EuFCsE@t؍d$$"ٝtC sٝp&ٕpٝttC,@fD+pbDP$X'C,ٝ|@fD+pbDP$XWD؅|ٝ|م|3E@t؍d$$]C(sٝxEuمpd$$مtd$$d$$Ed$$Ed$$Ed$$h*@EP@8t=hDuhB*@5 ^DEPhD*@5 ^D =hDs,م|d$$مx%+@d$$Ed$$s0Cd$$C d$$Cd$$Cd$$Cd$$Cd$$C d$$d$$Cd$$h`*@5 ^D pt=\DtEPhD*@2م|}UE mU]mEh[^] $Id: xnd_mini.c,v 1.1.1.1 2000/05/28 13:14:00 berar Exp $ min_lin(xnd_main.c)vectorlsq Position %.3f (%s), min %.3f (%.1f), opt %.3f (%.1f), max %.3f (%.1f) quad minquad maxlin. Shifts at %.3f, ending position zzDaaDt&Mb`?{Gz?}:?@&U`WVSh\.@}]hDU0gDVD]/@]/@]gDUU] _D1 _Dhp.@jS_c]Dw.@19}1 ]DaDgDv'@9|hDVEd$$h{.@5 ^DE /@Eu&Ed$$d$$h.@5 ^D}؃=hD~*Ečd$$0gDd$$h.@5 ^DFE/@Eu'Ed$$Ed$$h.@5 ^D h.@5 ^D=hDPjj =dDt =hDEgD /@ـEE /@E=hD0gDU]E]EU]VD]EeEeEuEU]E]Ծ.@EU]E]Ծ.@EeMEeMEeMMMMEeMEeMEeM(/@Eu 0/@]G1VD]EuWEEu0gD]E]t&0gD]E]=hD~E]E0gDVD]:EEuE]VD]E]VD]E 0/@]EE%0gD 8/@EuE/@Et2EE%0gD 8/@EuE /@Eu]E0gDtLEu@/@EtEUEu ]EuEUU%0gD] U]Ⱦ.@19} aD]DvE @9|VD YDhD=hD 0gD /@ gDEu E0gD0gDd$$h.@5 ^D19}- aD]D0gD@9|5]DJhD _DEVD+hDYDXe[^_]historyt& Angle and projection of calculated motion on previous motions : [%d] %6.1f %g t&9RFߑ?U WVS=ZDu`h4@jbD@P]`PDh4@j5 _D](@D1ۃ h4@j5 _D]¡`PD CbD@9|֋ZD(@D1; _D}4 ZD(@DaD5 _D'C9|5ZD(@DE@t؍d$$ø1; _D}FZD`PDE=aD}5(@D _D}}4C9|=ZDh4@5 ^D81;5ZDt&'1; _D}!`PD aD _D C9|d$$ZD(@D4d$$585@d$$Vh#5@5 ^DF;5ZD|h.@5 ^De[^_] resize errort&'US} _DP5aDaD@YDP5VDVD _DP5(@D(@D1ۃbD@9t& _DP`PD4^¡`PDCbD@9|y _DP.aD@YDPVD _DP(@DbDP`PD1ۃ _DP¡`PDCbD@9|hW7@1=aDt=VDt =(@DuPX]] $Id: xnd_sng.c,v 1.1.1.1 1999/11/21 08:51:00 berar Exp $ sgn_traite_hklE_RDATF Read Data file%4d %3d %3d %3d %3d' %7.1f %7.1f ( %7.1f %7.1f ) 'U`WVS1h8@[S5YDjjEPth 9@j4]D hD1ۡ jDE9}05jDjM&]ff0CU9| dD@_D cDD_D pfDH_D WD @_DeD WD ZD D_D gDeDeDE@t؍d$$fYDjD5YDXDP4P0P,X(1eDkD;}#WfDǃFkD@eD;|1ۡeD;}a1TkDL;4}+t&W fDǃFkD@eDL;4|CeD;|=XDtjD@(@0X(@,@4X,jD@(@,E@t؍d$$<]EVD `DmU䡰iDM@XEME@ X @EX=dD=hD11;5pPD}!PDpPDF9|1;5pPD}PDpPDF9|]DfD5VDK`lD=PlD~v'lD=@lD~G'jLÃtPDPDVDGlD@lD;@lD|ơ`lD@`lD;PlD|=YD,EEeDkDE;y&kDp4J`lD;PlDt&lD; @lDt&1xVKÃthVDE@tRPDjDM0`DB( ]Ԁ=P[Du4`DB, E]KPDM5VDGFkD;p(zlD@lD;@lD_`lD@`lD;PlD(kDP(UЃx,p8I`lD; PlD'lD;@lDt&1xVJÃthVDE@tRPDjDM0`DB( ]Ԁ=P[Du4`DB, E]JPDM5VDGFkD@,9ulD@lD;@lDZ`lD@`lD;PlD#kD@,EСkDx0 p<~H`lD;PlDlD;@lDt&1xVfIÃthVDE@tRPDjDM0`DB( ]Ԁ=P[Du4`DB, E]gIPDM5VDGFkD;p0zlD@lD;@lD_`lD@`lD;PlD(kD@0EE܃kD@eDU;EeD‹M;hETM؋kDLU;$kDp4G`lD; PlDt&lD;@lDt&1bVGÃtRPDjDM0`DB( ]Ԁ=P[Du4`DB, E]GPDM5VDGFkD;p(|lD@lD;@lDy`lD@`lD;PlDBEܡkDP(UЃ@kDeDLU܋M;E؋eDM;1;5pPDPDẺ‰U PDME̋E܍^;pPD}QMU=pPD&'EE@tE9EuC9|F;5pPD|1;5pPDPDUȋ PDMġaDEUMVDEpPDUvMȃ<HEEU EɋM19tEEE@E܉EM}&'U<t7HE؋U9 EEE@E؉E C9~F;uO=dD=aDjDBnPBlPBjP5_Dh"9@5]D1;5@bD}/]v'DsPh29@5]D F;5@bD|ޡjD@,d$$@(d$$VDd$$E5`Dd$$h@9@5]DD(He[^_]sng_crystal(xnd_sng.c) EXPERIMENT '%s' at %.3f PHASE #%d : '%s' %s deriv#%s a %f # h k l m%d& f_obs f_calc ( f_a f_b ) RwF=%.4f RF=%.4f n=%d RwF=%.4f RF=%.4f n=%d UWVShD@F=hDu3=gD =WD~!PVDd$$5`VDhD@KjDE@hpgDZD ZD`VDA;9A eDPmFPVDeDآ  hD]D hD=hDu&ZDp RjD@hPhD@5 ^DeDlDt)`gDP[Dt`WDZDB0jDB jDB$fDB,dD3؃=hD=dDuxeDtjYD1;5`WD}_t&hD@j5YDK0`D =XDuhD@j5YDsKfD F;5`WD| YDpPD5VD@@`lD=PlD~dv'lD=@lD~4'j)AtpPDlD@lD;@lD|١`lD@`lD;PlD|=YD5EeDkDE;1kDp4?`lD;5PlD}v&'lD;5@lD}C&'1Sf@tpPDCkD;X(|⡐lD@lD;@lD|ˡ`lD@`lD;PlD|kDx,p8>`lD;5PlD}ylD;5@lD}H&'1S?tpPDCkD@,9|ݡlD@lD;@lD|ơ`lD@`lD;PlD|kDx0p<<>`lD;5PlD}o&lD;5@lD}C&'1S&?tpPDCkD;X0|⡐lD@lD;@lD|ˡ`lD@`lD;PlD|EkD@eDU; 1eD;t&ETkDLU;1&kDp4C=`lD;=PlD}v&'lD;=@lD}C&'1S&>tpPDCkD;X(|⡐lD@lD;@lD|ˡ`lD@`lD;PlD|EkD@eDLU;GFeD;=pPDt1hD@j5pPDiGPDhD@j5pPDRGPD=dDtq=aDthPVDd$$5`VDhD@5]D1ۃ;@bD}$&CShE@5]D ;@bD|h E@5]DjD`VDBi]DfD5VD;j`<fDjS<`D =XDu蜔]D hD_DPVDx~)'_DB_DPVD;P|=hDiD_DB,PB rd$$B2E@t؍d$$踡ٍd$$h`E@iDp,@ pd$$@0E@t؍d$$hٍd$$hE@5 ^D64=YDtC1;5`WD}9t&0`D=XDufDF;5`WD|˃=pPDt5PD5PDeDt&1?EjD@hZDDE;XD ?iDU@_De[^_] $Id: xnd_res.c,v 1.1 2002/01/10 15:24:41 berar Exp $ residu xnd_res.c)mod_lsq Erreur maximale a %.3f : %.1f, %+.1f sigma, %.4f R Bt&-DT!@@@UWVSUUU]]]EpcDƒxtphN@U==`[DtEP!xthN@j5 _D`CE `VDuDžlEPPw DžlEPVD@0_D};=PYDjuءlDUpVDEju؋lDUEUlwÈ@s]O@EɀE]u]ٝhEȍd$$讣؍h]]UUU.&'EUEMUEU]EtO@EEunEemM}eEݝ`EE@t؍d$$耝܍`]EEd$$.]EEu]ujuء lDuju؋ lD҃ju؋ lD]ttTEEuu]E؍d$$jE}ME mM}mEUP lDЃ ju؋lD]ԃEE@t؍d$$h]EeUE]ȡiDEMEMU@XE@XB EueZ tnEeٕ\d$$c}iDM@XEM@Xم\@XB EueZ iD@0}tiDEe@(X(E]EUEuE]]0_D]EME|tkEEUݝP݅P O@E@t؍d$$܍P]E(O@E}UME]E}tiDE@XU]EᡰiDE@X=`[Dtuuu؍EP*ptx]t]1;5 _DFPuءlDEMUЃE@t\aDEM19EFƉЉt&'CPu؋lDҍ;VDMC9~F;5 _Dkx|tjEME]1;5 _Dt&'FPu؋ lDUЃE@tEMMЋ}F;5 _D|}1;5 _DaD<VDL _DHE} <19i!t[^_]ÍUW} _]Í&UUM BAZBAZBAZB A B BAZBAZB A Z BAZB$A$B$]Ít&9RFߑ?USjD@dP`P\PXPTXP=hDu@l@d$$菉[DjDl@d$$茈VDXDE@jDZJPVD@0_D;PYDsbBL9Zv'0_DjD fDjSlDЍd$$%d$$S80_DCjD@L9~]]Ð}:?&US]jSlD]jSlDEEm@EuE uɅt 0_D`PYDH9t0_D@ &Eu$EujD@J9u5Eu$EujD@L9um@]ME M] jD@PXPE @TXTE @XXXE @\X\@djSlDm@EujDE@`X`؋]]}:@U WS]߸ jDxdu t& jDAX(o@fEu APqXYP jDA\(o@fEu ATq\YTjD@DHP%@DHTH$Eu؋jDB`(o@EuSBXEuGB$rX]E@t؍d$$~M]E]EjDR$Eub$ ءjD@$#S[[C E} jDPHR$ZH8H u'A9 tϹЍxEuhCd$$CsE@t؍d$${ٍd$$d$$s C3d$$Vhq@u0d$$s Vhq@ub{$CEukd$$Cs E@t؍d$$,{ٍd$$Cd$$s$Csd$$hq@Whr@uݿ4%Cd$$s$hq@Wh@r@u趿hdr@V8=PWDfEu1d$$s Cd$$APhfr@5P]DN "d$$s Vhzr@5P]D*{$tNCEu$s$Cd$$hr@5P]Ds$hr@5P]D־ h;\@5P]Dþe[^_] $Id: xnd_unc.c,v 1.5 2003/04/10 15:37:30 berar Exp $ ' %9.3f (lambda 0) %s=%9.3g added to ical UVS]u jS0lDЃ =dDt_jDxiuT`DtKPYD%u@؉1u.E d$$u0_Dd$$hu@5 ^D诽=`[Dtu XDPS0lDЍe[^]profil_tds_0(xnd_unc.c)dif_nature invalidetds_0009RF߁?t&U WVShVv@-XDtP_D@'t&XDt P_D@ hnv@]D hDeDjeD؃eD4j]jD@i]DfD5VDjD@iPifDjD@i@PPWDeD WD`D]D hD1PVD@0_D ;=PYD~]0_D v@d$$x]EphDE@t؍d$$vcDphD5fDYD cD}5phDPD1eDkD;v'kDp4kD@$uj>؃&jkDp4 ؃j v@ YD YDd$${]P_DWD]jEME]FkD@eD;K1ۡeD;1TkDL;4kDp4kD@$u jNjkDp4  v@ YD YDd$$z]P_DWD]jEME] FkD@eDL;4ZCeD;'hv@uWy G0_D;=PYDjD@ijDPi`VD;e[^_]profil_tds_hkl(xnd_unc.c)&9RF߁?&Uhz@ 0_Dz@d$$u]EE@td$$s؃]DfD5VD jD@iP E cDd$$(U]E%phDd$$UEd$${EEMMM ]$EEuhPDd$$u EpVDE]tds(%d,%d,%d)9RFߑ??USjD@@{@ {@]eD4 j jDH$]phD}]j ]jDBnPBlPBjPh{@hPD裷@@D[D ;PYDsvPVD@0_D 0_DC;PYDsuuuSuڋ[DKPVD@0_D -0_DKxuuuSuދ]]gen_uncoherent(xnd_unc.c)compton dl %.3f dl_min %.3f dl_max %.3f resol %.3f dl_eff %.3f cpt t&?L?9RFߑ?ZӼ?U WVSh }@XDtP_D@'t&XDt P_D@ hnv@`VD t0]DfD j  }@] t&]]D hDeD jz eDeD4 eD tCt:jC  }@]}@ eDfD fD]+fD fD}@]j  }@]jD@it&]DfD5VDjD@iP fDjD@i@P WDeD WD`D]D hD1PVD@0_D ;=PYD]0_D }@ }@d$$p]EphDE@t؍d$$ o]EcD cDVDphD5fDYDEPD`DـE@t( VD VD`D PDPDEE@K%VD }@]EEEEEtEEut&EuEÈ@s kؐt&EEuEEu Eu9؍vEEu E t&E }@u]E PDPDgfff)k9u9d$$Ed$$ʍd$$ɍd$$d$$h@}@,؃=WDt+phDYDEujD5YDH8X8؋eD1ۋkD;}G&kDp4P_D]jME]CkD@eD;|1eD;1ۋTkDL;}Gt&kDp4SP_D]jME]CkD@eDL;|FeD;|\1ۋeDkD;}AkDp4P_D]jME]CkD@eD;|PD `DMh}@d$$W G0_D;=PYDjD@ijDPi`VD;G=dDt`Dth}@5 ^Dm e[^_] $Id: xnd_hkl.c,v 1.3 2002/06/19 09:57:10 berar Exp $ -DT!@-DT!}:п&UWVSDžDžDžDžkDP(p4vj/ٝj"ٝjٝjݝkD@$uIjd$$AݝkD@%tj eDݝDž*1ۍuCPC~Dž kDx0p<kD@$ t. 1ۍX'S:C ~kD@$@t%1ۍt&S C~kDx$y%1ۍt&SC~kD@%t%1ۍ0t&SC~=YDtd1;=`WD}Z `WD$ 1;}, 0`Dv'Uڋ1C;|G;$|lDDžM|jDBjP$XBlP$XNBnP$XN]BjP$XN BlP$XNBnP$XN]BjP$XNBlP$XNBnP$XN ]BjP$XN$BlP$XN(BnP$XN,مMمMمMݝ݅ 8@ݝkD@$tEP|EP腖ݝ m܍ݝ~h܍ݝkDx0,ݕݕݝݝ@$ tEP|XP膖ݝ kD@$@t"P|Pݝ kDx$y"|P|XPܗݝ kD@%t"P|0P?ݝ ܅܅ݝ ݅܅ݝ(݅܍ ݅܍(ݝ܍ ܍(ݝ݅܅ݝ=P[Du݅܅ݝ=YD݅ @@ݝ=P[Du݅ 8@ݝ1;=`WDExt kDpΉ,`WD(t&'1ۍ v'Uڋ0`Dxt 1C~ыp@$tj1ۍlM؉4v'M0`Dl1 hXC~ˋ,x0@$ 1ۍ4hEdU` dڹ0`Dh` 1ܵ C ~pF$@1ۍ\UXT4'Xڹ0`D\T 1ܵ C~p~$1ۍPUL|H4'Lڹ0`DPH 1ܵ C~pF%1ۍDU@<4'@ڹ0`DD< 1ܵ C~G;(0lD9N5P_Dٝ=XDuBT؅ٝWD؍݅ٝkD@%tD݅H@Eu/مݝ0d$$bܵ܍0ٝءjDم܍@(X(=P[Du܍@,X,؃=XDu[SWD܍ٝ1;=`WD}8jD0م `WDt& G9|؃=YDu1&1;=`WD1ۍ &E؋0`Dم C~0`DWD؍ u\ kD@$0`DeD P@ ؍\;}5 0`DE؋1م C;|kD@%݅H@E|d$$f0`Dܵ eDصUL\C;}4 0`D&E؋1م C;|؃=XDuB1;}84t&UڋfD0`Dم صC;|G;=`WD7[^_]fhkl(xnd_hkl.c)t&UWVS1h@]D hDjDR4R0R,Z(eDuZ(1ۋeDkD;}2 WfDǃCkD@eD;|1eD;}a1ۋTkDL;}+t&WfDǃCkD@eDL;|FeD;|jD@(@,VD=XDt@0@4VDVDNVDe[^_]Í&'UjDBjP$X@_DBlP$XD_DBnP$XH_D]ÍU0YD҅uZDxtp^t v1]Ív'U\D҉¡jDfPH襂`]DСjDPHR$ZH8H<ɉ]Ít&US]jDf@HilDp$ [DKSjDH<]]US]jDf@HX,dD@_D cDD_D pfDH_D WD @_DeD WD ZD D_D gDeDeDeD``DEhDEeDE@t؍d$$SYD@ YD fD]EphDd$$q^jD @]E0fDEt]DEu1S*]]É'UjftlDuWDЀ=`gDTjDxlt0fXjj'tlDuWDСjDfXjjDfzltAfBlf;Bjt7fznt0fZljtlDuWDСjDfXljDfznt:fBnf;Blt0fZnjtlDuWDСjDfXn=`gDRuOjDfxntCfxjufxlt5jDfXnj:tlDuWDСjDfXn]gen_hkl(xnd_hkl.c)?@@t&U0VSh@@ pfD WD5cD-ZD]Ed$$3pfD@5cD-WD @]EWD@5cD-gD]EjDf@n hD]]EـEu] ؐ&jD@nP$XMm]EEE@t؍d$$P @5WD]jD@nP$X ZDWDUEd$$Y}EE mE]mu=`gDAt =`gDLu>jDfxnt2Eed$$S}EE mE]mU$=`gDCt =`gDTujDPnv1ҡjDfPl9 v'jDJnP$X gDRlP$X WDP$X ZD]Q$Y WDR$Z pfDUd$$0cD @E%hD]EEIE@t؍d$$OcD]EUEd$$X}EE mE]m]=`gDMu jDfxnu)=`gDNu jDfxlu=`gDAu;jDxlt0Eed$$8R}EE mE]mU<=`gDCt$=`gDRt=`gDTt=`gDQt =`gDHu jDPl1ҡjDfPj9(&'jDf@j@j9~ءjDf@l@l9ءjDf@nE e[^]Ít&UWVSlDp$ 1{t&eDÃt31;}@ jDj'fVfQB;|jDf@nf@lf@j_SߡeDơlD;8|e[^_]make_hkl(xnd_hkl.c)orienderiv %d hkl (%d non nuls, %d generes) t&\(\?RQ?4Ct&9RF߁?&UWVSh @=ZD@lDeD `eDtjp]Dp]D=lDt/lD`gDP[Dt`WDiDjDǸjDEBhZDB0jDB jDB$fDB(`]DB,dDB0WDB40WDB8\DB@0YDBWDBlD[DeDtPD@feDuPD0@FlDx$t@$x t PD@ PD@jj PDeDt#h@jkP`Dp `DeDtYh@jk P ]DZD xteDtlD@ $eD$S  ]DeDt$1=dDt=hDPEY=hD=dDyeDtkYDtf1;5`WD}\h$@j5YD0`D =XDuh$@j5YDfD F;5`WD| YD]DfDdDbDp]Dh@]E0fDEu0fD@`DbDp]Dp@]E]Dx@Eu]DءjD@it&5VDjD@iPsfD=XDu:jD@i@PIWDeD WD`D@ 0fDd$$I5fD]Ed$$)``D@ ]Dd$$I5fD]Ed$$W)hD0WDЃ=PD~=PD@u ]Dى PDjD@ijDPi`VD;=PDy,lDPD؉PDPr$zPD=YDtI1;5`WD}?v'0`D=XDufDF;5`WD|ˡeDtHh=`Dt5`Dȋ= ]Dt5 ]D豋=hDu%5]D5`YD5_Dh@@5 ^D{e[^_] $Id: xnd_rad.c,v 1.5 2003/04/10 15:37:30 berar Exp $ distribradial_dist : %4d (tth=%7.3f q=%7.2f) -> %8g t&9RF߁?-DT!@?}:-DT!)@UpWVSEd=hDuh@5 ^DskM 9 PYDvPYD1AEԉEԡeD~E؉E$t&eDډU܋Uh@jeD9Eh@jeDEh@jeDE@YD1ۋeDkD$;t&P_D]Ѓ=XDu]7EЍd$$%]7d$$%EE@t؍d$$DDًU EЋECkD@eD;nh@ju/E]D hDeD81ۃ;]}&SEC;]|h@juEeD8@@EjD@i U&]DfD5VDjD@iPIfDjD@i@P0WDeD WD`D]D hDEPVD@0_D 0_D @d$$D]EphD5fDYD @]E@t؍d$$BcDk]1ۋeDkD;vkDp4j<]P_D]=XDu9.5Ed$$#]W5d$$#EMUur#MEEU]ECkD@eD;Y1;]&'ؙ}܉EȋE u D$-EH9u UdEDd (@]EE]E0@Eu.E 8@]d$$BMuU EEE UC;]FE9Eu.E `D]ċEE0MEġjDH8]`t&]1ۡeD;}E`DjD@8t&‹U UU4E]C9|uju0lDЃ =hDuCE}ԅu8Ečd$$Eȍd$$0_Dd$$uh@5 ^D$=@WDq5VDo]DfD`lD;PlD}k@lDjDE=PlD lD9}&Mڐ&AiplD@lD9|`lD@`lD9|VÃt(E5WDɍd$$CPu0lDЃ ]D hDeD`lD;PlDlD;@lD}V'j Ãt*[`bDEɍd$$CPu0lD҃ lD@lD;@lD|`lD@`lD;PlD|eD`lD;PlDv'lD;@lD}{'1;5lD}UV:Ãt7MġeD`bD d$$CPu0lDЃ F;5lD|lD@lD;@lD|`lD@`lD;PlDWU9UeD8`lD;PlDt&lD;@lD}}'1;u}Z'VJÃt<EE0M `DjDH8ɍd$$CPu0lD҃ F;u|lD@lD;@lD|`lD@`lD;PlDUeD8`lD;PlDv'lD;@lDt&1;u}d'VZÃtF}܋EE4E `DjDH8ɍd$$CPu0lD҃ F;u|lD@lD;@lD|`lD@`lD;PlDK&=`[DtuġjD@hPu0lDЃ E0_DU;PYD:jD@ijDPi`VD;uuuuue[^_] $Id: xnd_amo.c,v 1.4 2003/07/16 15:05:55 berar Exp $ int_rdfpeak(xnd_amo.c)wxnd_iq.datt&# q i(q) = i_rdf + i_rlim xnd_frdf.dat# rdf& N=%.2f e- between %.2f(RLIM) and %.2f(RMIN) => =%.3f deriv echelle %f = phase_echelle %f * exper_echelle %f RDF %4d %6.3f q %5.2f ycal = %6.2f ~ %6.2f+%6.2f*(%.3f=iq + %.3f=iq0) -DT!)@@9RF߁?-DT!@-DT! @}:UWVShW@=hDuMhn@hp@s~Eh@P}hn@h@V~h@P} h@5 ^D}eDU싀<]@]@]Eeu}EE mE]mh@j}GWxẼ =@WDtCh@jk]SUEȉEċENjUȍEEǍESjR=}]EE9E &']EME]eD811ۃ;} Sz]CPn]CPb]EeuU @ɍd$$<]E=@WDt+EEUEMuUuUEE]G;}hE}EME]G}E9=hDuZEEMEM@=@]E؍d$$Eԍd$$Ed$$d$$h@d$]D hDeDj@]؃=@WDth@jkEP`EЃ jD@i` ]DfD5VD7jD@iPfDjD@i@PWD]D hDeD WD`DWDd$$eDd$$`Dd$$h @5 ^DozPVDPUE@0_D,9U'0_D @d$$6]EphD5fDYD ȵ@]eDE@t؍d$$4cD^UU]`D е@jDH8ٝx1ۋeDkD;t&'kDp4j\ٝtP_Dٝp=XDuMH'؅pٝpمt؍pE]e'مtE]مp!&مt؍pE]مp؍tE]CkD@eD;AE]EE]=@WDtkE Pjux ];]Eص@f&'S$[MEٝlE؍lfEu(ݝ`d`4ܵ`]Eمl @M؋},ME]=@WDtj11;M}aمxMEɐ&E} }} }D\} ED\A;M|C;] EME؍x]EMٝ|Eص@Eu`EݝXم|ݝPTP8܍XݝHTP3݅HEMٝ|EMEص@EuZEݝ@ݝ8<8E8܍@ݝ0<883݅0EM]EE @ح|]مxMEUd$$ju0lDЃ =@WD5VD]DfD`lD;PlD}f@lD=jD,=PlDlD9}&,ڐt&AiplD@lD9|`lD@`lD9|VÃt)4E5WDɍd$$CPu0lD҃ ]D hDeD`lD;=PlDlD;@lDt&1;5lD}j9Ãt`u)`bDEɍd$$CPu0lD,ZمxMMuɍd$$CPu=0lD׃ F;5lD|lD@lD;@lD``lD@`lD;PlD)eD`lD;PlDvlD;@lD}|'1;5lD}VV*Ãt8|MeD`bD d$$CPu=0lD׃ F;5lD|lD@lD;@lD|`lD@`lD;PlDVeD8a`lD;PlDFlD;@lD}g'1;5lD}AVJÃt#} d$$CPu0lDЃ F;5lD|šlD@lD;@lD|`lD@`lD;PlDk eDtpEхu`Ed$$Ed$$Ed$$Ed$$Ed$$Ed$$0_Dd$$uh`@5 ^DqD=`[DtujD@hPu0lD҃ E0_D}9}tjD@ijDPi`VD;uq=@WDtuzqurq=hDu uq[^_]Ðt&UVS=hDuh@5 ^DqeDjD@i]DfD5VD+jD@iPfDjD@i@PWDeD WD`D]D hD1ۡeD8jD 9}t&CjD9|jD@ijDPi`VD;Me[^]Ít&?cܥ\@U@ fDud$$5 @]E]Í&9RF߁?U@Md$$,]EphD5fDYDE@t؍d$$*cDSYDeDjD@kDP_DСjDX(jD@kDP_DСjDX,`DH8H(H,QD] int_dist_lambda npos %d amo %d %f %f t&USjDSh@5 ^Dn ]D hDjDp 1ۡPVD@0_D;PYD|t&0_D05QDjS0lDкQ)k29u/QDd$$0_Dd$$Sh@5 ^D'nC0_D;PYDr]] $Id: xnd_cal.c,v 1.3 2002/09/11 15:41:01 berar Exp $ 'UWVSE1 PYD10_Dt+D)ƍu~9u؉0_D[^_]ÍUVS1jDXD]@`DEEu]ءjD%XD]dDEEu]ءPVD@0_DjD0([DÃ;PYDPVD@0_D 0_DFC;PYDs#S]u0_D]È@r̋jDf;PYDufHfBL[DKPVD@0_D-0_DFKxSm]u0_D]tՋjD؅y1fBJe[^]traite_hkl(xnd_cal.c)negligeablenon visible (%d)%3d%3d%3d (%d) %7.3f %6.1f (%6.1f %6.1f) %s --- (%d)%3d%3d%3d (%d) %6.3f %2d %7.2f %7.2f %6.0f (%5.1g %5.1g) %5.3f sqrt(%5.3f) non positive width &USh@`YDOVtI=dDupft-_D1ۃ=gDt5gDj5]D5jDDk=dDaD@u@PjDB,d$$B(d$$B$d$$d$$BiPBnPBlPBjPBhPh @5 ^Dj@jDBd$$Bd$$B,d$$B(d$$B$d$$BeD+1;}%Ít&L; |ȋL+ F;|1[^]É'UVSE1p4N`lD;5PlD}s'lD=@lD~D'1ۍ&'S*tFC~졐lD@lD;@lD|ɡ`lD@`lD;PlD|e[^]Ít&'UWVSE up4虺1ۃ}SJC~Ep4s1ۃ&'SMD MDMD$EC~PuPE@t؍d$$ ]Ee[^_]Ð %3d : %6s -> %6s : d=%6.3f dd/s=%5.2f (%5.2f %5.2f %5.2f) deriv_dist UĀWVS]eD@UEEp]j]UB]B EE};: E06EUċB0&EEċxEPEPWuu6UeuUd$$E] =dDt\=hDuSEd$$Ed$$Ed$$Ed$$Ed$$uuuh@@5 ^D$d<=hD1Eԍ&'kMDMDMF~uuÉ]Ur`lD ;=PlD}WlD;@lD}-'jtElD@lD;@lD|ܡ`lD@`lD;PlD|}h}@jupEEh}@ju[ENjUr4K`lD;PlD'lD;@lD}e'1ۍ&'Sƃt$lE uuEEFC~ǡlD@lD;@lD|`lD@`lD;PlDmUr4肶`lD;PlDt&lD;@lD}i'1ۍ&'SZƃt(謷EuuEEFC~álD@lD;@lD|`lD@`lD;PlDiUr辵`lD;PlD}ut&lD;@lD}G'j詶ƃtuEEFlD@lD;@lD|¡`lD@`lD;PlD|1;u|aDU=VD}ECÉEEU }1;U}0Mt&'}9E} B;U|F;u|ud`u\`ẼEŰE;`=dDt=hDuh@5 ^D`EЃEeD};Et[^_]Ð %3d : (%6s -> %6s :%4.1f) (%6s -> %6s :%4.1f): a=%6.3f da/s=%5.2f deriv_angl9RFߑ?UWVSٝpeDDxExv聳j:ٝdFٝ`F tEU;|M8t&t6SP1E4 tBk4448tX4k D*PD*P4484P\.G~EPEPEPOٝ\EMؽ\ٕXd$$5P@ٝlمXE@t؍d$$=X@5P@ٝTمlإdص`ٕhd$$H؅pٝp=dDtp=hDugمhd$$مld$$Ed$$8pPEd$$uPuh@5 ^D:]<=hDwPuË8rƉDxq&`lD;5PlD}flD;@lD}0'j tDlD@lD;@lD|١`lD@`lD;PlD|DhE@jD臻LHhE@jDi@U1ɉÐ9kUU UE UA~F~E}~[^_]Ð9RFߑ?&UpWVSu}]CP@]E]uuy]uu{]ЍCP诎@]E]uuC]̃ uuB]ȃSv@]E]uu ]uu ]EMEMUM]EUM]EMUMm]EM]EMME]EMM]EM]EM]EMU]E]EPWV9(=dDEM]EM]EM]EM]EMM]EM]EM]E]E]1ۍu@&'1kt&'  00B~C~؍EPWu UU]EMEMM]EMEME]EM]M]EMEMM]EM]1ۃ u@1kt&'  00B~C~؍EPWuUU]EEEME]MEMM]EMEMM]EMM]EM]EM]1ۃ u@&1kt&'  00B~C~؍EPWue[^_]ini_blk (xnd_blk.c) Relative coordinates of atoms in block #%d atomesrelatvarici 81 r_siz %d %6s x %7.4f y %7.4f z %7.4f t %7.4f bij %f %f %f %f %f %f b %f UWVShS@zE|LP-eDHWDDž;h'5WDEWDP @kDžx`lD9`lDb&'DžDžlDDž9lD}A&'P辉tlD9=lD|͋9~ plD9 lD}Z&DžP.t~lD9lD|x9~ x`lD9`lDDžP.A~PLP|PEPEP}th@5 ^D2 h@j@eDL4eDTp DžPl L;<~t&plh@jHj~hpC4h󫋝l[4dSG=lD@lD5PlDDž9}= 赆B9|Dž`lD95`lDO&DžlD9lD}Y&'Dž蕆t~lD9=lD|9~ Dž t ujlD9 lD}R&Džt ~lD9lD|9~ `lD95`lDx`lD95`lD&DžlD9 lD}6&'j9tlD9lD|؋9~ Džt ~lD9lD}fDž9}4&蕄t9|lD9=lD|9~ Dž unlD9 lD}Vt&'Dž t ~lD9lD|9~ `lD95`lD)u Dž|9}||hY yӉh@jRËhY(h@jVhG0h@jVьG8Dž$9`v7`k D(P& t 1\E܉8h@D\k h@D<@Dk@D<8 `LF~M܍kh@Dh@Dk@D@D `LF~`Dž |9|9m=dDt =hDh@觉Dž9n&`lD|9`lD.t&|`lDpW4z0B8tDž+5WD@lD9lD}at&P>t/tttlD9lD|lD9 lDDžPt\tPk DPaٝX6؍XttxlD9lDPd}lD9 lDu܍v'Dž~ttt9|`lD|9`lD9}hC(@ d$$C(@d$$C(@d$$C(d$$ph@5 ^D$, t ukhG(@$d$$G(@ d$$G(@d$$G(@d$$G(@d$$G(@d$$h @5 ^DC$8(hB(@d$$hH@5 ^D$p@l@eDL;}t5 ^D#eD;0}$[^_]ini_blk (xnd_blk.cUVSh=A|1ۃeD;'1TkDL;4}]t&kD@4p(4#kD@4p0$#kD@4p8#kDp4#FkD@eDL;4|eDT4"CeD;_:|e[^] $Id: xnd_cor.c,v 1.6 2003/04/10 15:37:30 berar Exp $ prefered orientationline profile orientation dependence function #%d used for %s : P%d(z) =invalid polynomial choice %+f z%d UWVSU] ueDveD4uP۸AuwAPRhA5 ^DV!hA1u uP~F81ۃ9U';@Dd$$h A5 ^D t]Ph&A5 ^D  C9~h+A5 ^D e[^_]Í9RFߑ?U0WVSUM uk =`DeDt&k,= ]DeD4uW_^u kC kS$u8A]E]uu]uu]CPt8A]E]uu] uu]E _D]E peDE _DMEUd$$]FƉ@DPVEP褻N@DPQEP~M8A]EE _DE peDE _DM_E peDE _DM_e[^_]Ív'UeD;u `D`VDeD`D]orientation?&U SjDXt&-DT! @@t&??t&9RFߑ?9RFߑUĀ`DـE@tjD ZD`DX8 ءjDX8`VD@u*eDtJtAjDphD&t&eDt tjDphD cDx8X8=WDt+phDYDEujD5YDH8X8ء`VDo`VDtjo [D`VDytjio]A iDA]A iDA]EMEMd$$jD]E^DH8X8EME ^D^Djn5phDd$$kjD]EeDH8X8phDeDjn]jn fD AA]E [Dd$$E AME@t؍d$$IE [D AE@t؍d$$ ]Eu [Dd$$kjD [D A [DEH8X8`VD $PAvAAEAEAAAEAEAAAAAjDA% [DAɍd$$]jDA [DAɍd$$]E]СjDA% [DAɍd$$M]E]jDA [DAɍd$$\ME AuA [Dd$$C]jD% [DAɍd$$]E]A [Dd$$M]E]jD% [DAɍd$$ME [D]EE@t؍d$$m [DA [Dd$$d]jD% [DAɍd$$@]E]A [Dd$$M]E]jD% [DAɍd$$ME A]EEEEPfDjD}H8X8] $Id: xnd_deb.c,v 1.3 2002/09/05 08:04:20 berar Exp $ пU8AM eDd$$]E]Ðt&UME U@Z@ZHZ HZ@HZ AJAJA J AJAJd$$]E]Ð&UME U@H Z@HZHZ HZ@Z@HZ@Z@HZ HHZ$1' @ ~]É?&UME U@HHZ@HHZHHAZ HZ@HHZ@HZ@HZ@HZ HHZ$HHZ(@HHZ,HZ0@HZ4@HHZ81v @~]É?&UME U@HHHZ@HHHZHZ HZ@HHZ@HHHZ@HHZ@HHHZ HHZ$HHZ(@HZ,@HHHZ0@HZ4@HHHZ8H AZ<@HHZ@@HHHZDHHHZHHHHZL@HHZP1' @~]É?>t&UME U@HHHHZ@HHHHZH4"AZ HZ@HHHZ@HHHHZ@HHHZ@HHHHZ HHZ$HHZ(@HHZ,@HHHHZ0@HHZ4@HHHHZ8HHZ<@HHHZ@@HHHZDHHH8"AZHHHHZL@HHHHHZPHHHZTHHZX@HHZ\@HHHZ`@HHZd@HHHZhHHHHZl1v' @~] $Id: xnd_der.c,v 1.5 2002/07/04 12:01:14 berar Exp $ }:9RFߑ?cܥ\UPWVS0_DjD fD}]EEd$$ju0lDЃ =@WDVD$AEu E5VD]]DfD5VDb`lD=PlDklD=@lD;'jD@iC9t&S:cƃ؅yC)‰Ѓt9 tt7tQ~hD _DfD %A]_E5WD]Q_D%XD `_D [D]2_D%XDd$$踩]SbE \D]bMd$$FPu0lDЃ CjD@i9lD@lD;@lD`lD@`lD;PlD5PbDkDx(x,p8P`lD;PlD&'lD; @lDt&1fSVQƃtVjD ;0`DB( ]=P[Du4`DB, E]wQEMɍd$$FPu0lDЃ CkD@,9|lD@lD;@lDp`lD@`lD;PlD9kD@,ǡkDx0pkDx0EkD@eDU;EeD‹M;Xt&'ETMkDLU;5kDp4CN`lD; PlD'lD;@lDt&1fSNƃtVjD ;0`DB( ]=P[Du4`DB, E]NEMɍd$$FPu0lDЃ CkD;X(|lD@lD;@lDu`lD@`lD;PlD>EkDx(@kDeDLMU; EeDE;t&eD=[DlDp$L`lD=PlDlD=@lD'eD[DHEP=Mƃt>M_D %A YD hD]Ed$$FPu0lD҃ ]CSLƃt|>M]SeLEMd$$FPu 0lDKt&[DHEPLƃt1L]uLEMd$$FPu0lD҃lD@lD;@lD`lD@`lD;PlD4&=`[Dt$ujD@hPu 0lD]EpVDEe[^_] $Id: xnd_ips.c,v 1.4 2003/04/10 15:37:30 berar Exp $ ini_pseudo_phase(xnd_ips.c)pseudo_phaseSET_0SET_%d The number of phases has been adjusted internally to %d to take into account sets of lines associated with modulated structures... Internal phase %d '%s' %s associated with profile key 'PROF_%d' Bragg structureerror in sets rulet&U`WVSEh=AM@bDh=AjD5XDSpgDZDEfDeDE;`fD'5eDUM eDlDZDJ ]ZBB`ZBB =AB$`@B(А@B,0@4'~B =AZD;`@u @B4=lD5lD<¡ZDP5lD距¡ZDP@5lDr¡ZDP85lD-¡ZDP0eD;EEt&ZDBDZDljSh=Au<uS ZDA eDk(`Aʃ8`@u @B4ZDCeD;|ZDD)LEeDd];`fD-=XD5h=A5 ^DlXD;`fDtPh>A5 ^DK EpgDZDE;XDZDP eDp Ruh>A5 ^DeDXtEP5ZD5E vEeD\t}u5ZDEZDpSEeD~tuh>A5 ^Dc EZDDM; XD+@bDp]Dt]Dh>A5]DjTPiDjDh>A}PN5 ^DeJe[^_] $Id: xnd_mod.c,v 1.2 2002/01/10 15:24:42 berar Exp $ 'UWVS1@_DjDjv'zP$XG~eD0to0uD11ۡ jD;}N4&'k8PEjDjDXP$X؆@_Dٞ@_DC jD;|G~e[^_]Í&UWVSeD00C11 jDE;85fDjDjcD]pfDWDWDZDgD}P$XM@_DMD_DH_DP$XM@_DD_DH_D\P$XM@_DD_DH_D\GE;8Z؍e[^_]genget_mod(xnd_mod.c)vector derivatives'UWVShJEAMGZDP jD@0jDfDeD0t$0x~h`EAjkP@MfD =fDMAuZD@8~ U[kv1ZD@Ef8~Q'1ҡ jD;}#jDj 0jDt&fDyfDSBG;|VEZD@9E|=fDMAuw=fDt5fDGFe[^_]genget_mag(xnd_mod.c)t&'UhFAFZD8u =XD uDZDB ADB jDB8~ DZZD@8uU)F] %s %2d sym %d (%6.3f %6.3f %6.3f) %s %2d inv %d -DT!@?t&{Gz?UWVSE=xGAݝ@Dž8T󫡰lD,A$GAHA0HA@HAHAHApHAHAHAHHAt&GAٕhٝdDž8vGAٕhGA GAٕhٕdٝ`Dž88t&GAٕhٕdٕtٕlٕ|ٝxDž8kDp4o?1ۃu&S@C~kDp8A?1ۃu؉'S?C~E LDž<U 1ۍEt&'LMD MDMD$C~1ۍELMD MDMC~1ۍUt&LMD MDMC~1ۍU<E& C~ꋅ<UلGAEu!1ۍU&C~Dž4s<45kDh;GA5 ^DV1;8PE0U,&1ۍ&'40kDx,,ݝ ۅ4ٕE݅@ɍd$$荥܍ ݝ,ݝمE݅@ɍd$$;܍܅0CEEEk ؄(\ۅ4Ed$$EE؄(Xd$$EE؄(Td$$hJGA5 ^D G;8U 8~45kDh_GA5 ^D0 skiping @SET::LOOP='%s' t&UVS]hoaA*C,`CAeD\ jDC;@bD~@bDC4EAeD0t C$MA(t&C$@AhaA jDx P.S&=ơ jDx uFC8S<Cxt@8u*Cp0haA5 ^D Sƃ`*e[^]HKL,M=%dsattelite 1 sattelite with M=%d according @SET::LOOP='%s' &'UWVS}Vh cA]SS0‹M APhcAjj/U BfBfxBpVh cA5 ^D1e[^_]Í&'error : %s invalid string for incommensutare in @SET::LOOP='%s' &'UE@pu hcA-]Í&'No @SET(LOOP) or empty one, assuming base line 'HKL,M=0' %hdM expected = expected, %hdHKLM= num expectedHKLM=i,j... too much values in one set %d sattelite(s) ( %d ) according @SET::LOOP='%s' UpWVSUBXt;u)h`dA{,t SrujSEPA9 t9,t9Ht9Kt9LtHqDDu9-u1EPhdAQ t SuEPqEA@ ٝ<م<؂`QDٚ`QDF~494|؃=YDu1Dž44; `WD=WDkDeDgAPQD `WDt&1k41ۋ UڋQD C~狅QD ;ۅ̋4F@ ЋU\ A$uc;ʋQD U\;0~k4 QDUڋ9 C;0|Nt&;0} norm = %.2f t&}:UWVSEhrA=ADteDAD;eDAD1;5`WD}I'1kt&'hsAj5AD;QD C~F;5`WD|=YDtW1;5`WD}M'1kt&'h@sAj5YD.;QD C~F;5`WD|]D hDADBAD.jDBnPBlPBjP5lD5ADhsAjDR4R0R,Z(eDu R(S1;5`WD}2`QD=`WDt&1kt&'C~F9|1ۋeDkD;}.PQDufDECkD@eD;|1;5`WDk ـ`QDـdQDـhQDQDpeD؈dQD_D؈dQD_D؈hQDU=jD(ثQDtAE@t؍d$$Cx;QD tAEuE4 ٚQD QDF;5`WD#jD@(@,VD=ADG=ZDu>@(d$$hQDd$$dQDd$$`QDd$$hsA$=YDtbEPQDeDkDE;}5uEPQDBPQDkD@eD;|VDe[^_]MAGNETMagnetic structureUPS]E SzB8hwAr3=ADuj0ADeDX jDC4FAChwAC C(tAC$gA jD@ClDPdC5lDUeC@5lDfC85lDfC01]]Ð Unexpected symmetry case in generating nuclear ops t&?&UWVS=ADuj0AD=ADE19}! AD'B9|ADEљÅ AD΀ufE uZ)‰Ѓu1~# AD'B9|ADAt FuB)ȃuAD@yA@(X(@,X,ADBt Fu>)‰ЃuAD@yA@$X$@,X,tcADCt Fu@)ȃuAD@yA@$X$@(X(t hyAjADe[^_] $Id: xnd_moco.c,v 1.2 2002/01/10 15:24:42 berar Exp $ ini_composite (xnd_moco.c&' @SET::LINES=%d>0 skiping @SET::LOOP='%s' t&UVS]1h{AC4pAC8CfBlf;Bjt4t0fZljL tlDuWDСjDfXlt4jD@l9t'j tlDuWDۀ=`gDRu>t:jDfxjufxlt'j tlDuWDC9jDf@l@l9zjDf@j@j;E$e[^_]Ðt&@&UWVShAhD5cDE@t؍d$$a}EE mE]m}hD5WDE@t؍d$$`}UE mU]muhD5gDE@t؍d$$c` AA}EE mE]m]E1҃=`gDMt =`gDAuڀ=`gDNt =`gDAu؉EjDfPj9&jDfUfPl9&jDf@n{j tlDuWDЀ=`gDTjDxlt1fXjjj tlDuWDҡjDfXjjDfzltAfBlf;Bjt7fznt0fZlj tlDuWDСjDfXljDfznt;fBnf;Blt1fZnjtlDuWDҡjDfXn=`gDRuOjDfxntCfxjufxlt5jDfXnj{tlDuWDСjDfXnjDf@n@n9jDf@l@l9\jDf@j@j9're[^_]genget_moco(xnd_mod.c)derivatives of vectorinternal error : current_sets->nb_hkl=%d&UWVShA]ZDH jDP0jD@lDfD=eDt)eD0x~hAjkPGfD 5 ^DlD8~ ]10jDEf81ҡ jD;}#jDj 0jDt&fDyfDSBG;|lDt$t$+t u"=1*t&lD0h@Aj E0jD9EfA=fDt5fDe[^_]Ít&'USjDXnfPpfPnZD@<Љ¡jDfXn[] $Id: xnd_sym4.c,v 1.2 2002/01/10 15:24:42 berar Exp $ &U1]Í&UjDPj@pyډ)jDPl@n‰)‰y؍Љ]UjDPj@p‰)‰Љ]Ít&'UjDPl@pyډ)jDPj@n‰)‰y؍Љ]UjDPl@p‰)‰Љ]Ít&'UjDPn@pyډ)jDPj@l‰)‰y؍Љ]UjDPn@p‰)‰Љ]Ít&'UjDPl@n‰)‰Љ]Ít&'UjDPnHj@p‰)‰Љ]Ðt&UjDPjHl@p‰)‰Љ]Ðt&UjDHjPl@p)y١jDPl@n‰)‰yȉ]Í'U jDQjAlAnAp‰)‰Љ]Í&'U1]Í&UjDPlHn@p‰)‰Љ]Ðt&UjDPn@j‰)‰Љ]Ít&'UjDPjHl@p‰)‰Љ]Ðt&UjDHlPn@p)y١jDPj@n‰)‰yȉ]Í'U jDQjAlAnAp‰)‰Љ]Í&'U1]Í&UjDPlHn@p‰)‰Љ]Ðt&UjDPnHj@p‰)‰Љ]Ðt&UjDPj@l‰)‰Љ]Ít&'UjDHnPj@p)y١jDPj@l‰)‰yȉ]Í'U jDQjAlAnAp‰)‰Љ]Í&'U1]Í&UjDPlHn@p‰)‰Љ]Ðt&UjDPnHj@p‰)‰Љ]Ðt&UjDPj@l‰)‰Љ]Ít&'USjDXj@lÉ)yۡjDPlHn@p‰)‰yÉ[]Ít&'UjDPjHl@n‰)‰Љ]Ðt&U1]Í&UjDPl@n‰)‰Љ]Ít&'UjDPnHj@p‰)‰Љ]Ðt&UjDPjHl@p‰)‰Љ]Ðt&USjDXl@nÉ)yۡjDPjHn@p‰)‰yÉ[]Ít&'U jDQjAlAnAp‰)‰Љ]Í&'U1]Í&UjDPlHn@p‰)‰Љ]Ðt&UjDPn@j‰)‰Љ]Ít&'UjDPjHl@p‰)‰Љ]Ðt&USjDXn@jÉ)yۡjDPjHl@p‰)‰yÉ[]Ít&'UjDPjHl@n‰)‰Љ]Ðt&U1]Í&USjDZlJpˉ)Bnȉ)É[]ÍvUjDPlHn@p‰)‰Љ]Ðt&USjDZjJpˉ)Bnȉ)É[]ÍvUjDPjHn@p‰)‰Љ]Ðt&USjDZjJpˉ)Blȉ)É[]ÍvUjDPjHl@p‰)‰Љ]Ðt&UjDPjHl)@p)‰UVUUUE)‰kU)‰Љ]Ðerror : non supported extiction setting &UhA] extinction %s t&UuhKA5 ^Df1]Ðini_4D_extinction (xnd_sym4.c)3D_extinction usedR4A4AA4PB4BB4PC4CC4PU4OU4QV4OV4QW4OW4QL4AL4BL4CL4IL4FL4PM4AM4BM4CM4IM4FM4PN4AN4BN4CN4IN4FN4PMN4AMN4BMN4CMN4IMN4FMN4PLN4ALN4BLN4CLN4ILN4FLN4PLM4ALM4BLM4CLM4ILM4FLM4PB@?&UWVS]C 1 jD &'@~ AA}EE mE]m}hAuhA#uC@AhҞAv  jD@ E@tELukDp$SPhqA5XḊh|AkDp4kkDx,thAp8PkDx0t hAp<5]]Ðkey @MAGNET is necessary for magnetic info SYMGRPCENTER_ZCENTER_YCENTER_XORDERMAGNETt&US]eDXC0PhAjh AsjjhAEPCPjjhAEPCPjjhAEPC PjjhŬAjsjjhάAhԬA|=lP ]]SWAP_COMPOCOMPO_SYM4COMPO_SYMCOMPOSIZE %d %d %d %d %.4f %.4f %.4f %s %s 'UWVS]eD\C0PEE{ t%C$Eƿ}A 8tC(Ejh AujjhAh AujjhAjs jjhAh AsjjhAEPCPjjhAEPCPjjhAEPC PjjhŬAjsjjhάAj3jjhAhA;ļuwsCd$$Cd$$C d$$s ss3hA5XD諄4}tuhA5XD菄 }tuhA5XDs hA5XD`e[^_]Ív'USeD`lD1ۍv'lD8~ jp$lD(CtߡeD;|ҋ]]new_crystalP1UNCOHBONDSETSBLOCKPROFORIENCRYSTAL%s %d %d %d %d %d %d %d %d%3d%3d %f UVShA~eD`t tfAfEAEeD;tjjeDjjhAjjjhAjjjhAjjjhAjVjjh AjjjhAjjjhlAEPjjhAhA9Ĩu=eDVhA5XDP$jeD eDt u eDweDt`eD0tj0{eDtzPm1ۃeD;}4'4h9A5XDs CeD;|hA5XDQjeD,eDP1ۃeD;}8'4h9A5XD CeD;|hA5XD~jeD$[D1eD`;})t&'js &F(eD;|jeD(hA5XD91ۋeDkD;}) CkD@eD;|桀eDjH1eD;}ovL4h=A5XD1ۋeDPkD L;} v+CkD@eDL;|FeD;|eDtj4eD PeD<hBA5XD~1$t&d$$hJA5XD~FeD;|ӡeD@jeDDjhA5XDl~e[^]new_quasi %d %d US]h~A/eD`0hA5XD~tjeD eDhA5XD}1ۃeD;}4'4h9A5XD} CeD;|hA5XDq}jeD$jeD(jeD`p$]]new_radialDISTNONCRYST %d %d %d 'UShAjjeDjjhAjjjhAjjjhlAhöA3Hu*eDh̶A5XD{|1ۋeDkD;} CkD@eD;|jeD8eDtj4]]new_rdfpeakPRINTATOMSRMINRLIMRSTEPPEAKSRDFPEAKSUShٷAjjeDjjhAjjjhAjjjhA<P<PjjhA<P<PjjhA<<jjhAjjjhAhA21ۋeDkDĘ;}&CkD@eD;|jeD8t?]] %d vUhٷAjjeDjjhAhA1 ueDh(A5XDZz jeD8]new_cdr (xnd_new.c)NEW fileaWEIGHTORIGBGROUNDLAMBDADATAFILETECHNNATURETITLEEXPERv %d %d %d %d %d %d %.3f %s TEMPSTEPSTOPSTART%f %f %f %f %.3f %d %s MONITVARSKIPSUM %d %f %d %d %d %f %s TRANSITPHASE %d %d %.3f %s %.4g %d # %3d %f on %secriture fichier new ApB=U0WVShAhAhAhcDXD=[Dtjj5[DUy 1@VD`VD;=gD&'`VDP>`VD࿃tt+t tv1t&`VD t`VD@t ]]jEP`VDPjjhAEPPjjhƹAjjjh˹AjjjhӹAjjjhڹAjjjh߹AjjjhAjVjjhAh ARjjhAhAO.ļu@`VDPـd$$SVhA5XDw, `VDgfff)ƒ1ۋPVD;Qv`VDPVD@`@HP$X]ԺA]غA]ܺA]jEPPVDRjjh$AEPEPjjh)AEPBPjjh.AEPRjjh3AhڹA'-XPVD@d$$Ed$$@d$$d$$h9A5XDu(pjh APVDP Rjjh߹AjpjjhAURPjjh$AhڹA,Du)PVDB Prd$$hIA5XDiuCPVD`VD;]`VDPVDjh AB Pjjh߹AjrjjhAEPCPjjhWAjsjjh]AjsjjhaAj3jjhfAEPRjjh$AhڹA+Ĕu<PVDB PCd$$ss3C d$$rhjA5XDqt,j`VDj`VDj`VDj`VD =hDtj`VDj`VD`VD tjG`VD ;=gD/hA5XDs1fDeD;=`fDt&eDP>eDu`]jEPeD PjjhƹAjeD@EܾVUUUыE)PjjhAjSjjhAh A5eDjjhAhA)Xu>eDPـ d$$H)‰PShA5XDrjeDAjeD/eDxthA5XDWreDt,t/tu%0#Y&jj{GeDd;=`fDd WDP5@]D YDd$$5fD5[DbDd$$hA5XDq(gDP[XD@ @thAje5XDsdXDe[^_] $Id: xnd_cif.c,v 1.2 2002/01/10 15:24:42 berar Exp $ cif_out (xnd_cif.c)cif_info Generating %s file read CIF info filer %d %8s %d %f %f %d %f %d %f %f %d Generating %s file without standard deviation real CIF fileaw.cif.map#================================================= # lines generated to be copied into a CIF # procedure in test # please, do not use with expended parameters _cell_length_a_cell_length_b_cell_length_c_cell_angle_alpha_cell_angle_beta_cell_angle_gammavoA~AAAAAdata_'%s' CHEMICAL DATAPOWDER SPECIMEN AND CRYSTAL DATA# Composite structure items _exptl_crystal_type_of_structure 'comp' _cell_subsystem_number 2 _cell_modulation_dimension 1 _cell_reciprocal_basis_vect_number 4 loop_ _cell_subsystem_code _cell_subsystem _cell_subsystem_matrix_W_1_1 _cell_subsystem_matrix_W_2_2 _cell_subsystem_matrix_W_3_3 _cell_subsystem_matrix_W_3_4 _cell_subsystem_matrix_W_4_3 _cell_subsystem_matrix_W_4_4 BASIS '1-st subsystem' 1 1 1 0 0 0 # following cell is associated with the BASIS subsystem CELL%-20s %s _cell_volume%-20s %8f EXPERIMENTAL DATA'_computing_structure_refinementREFINEMENT DATA# xnd uses %d experiments, following values are related to the whole data # xnd uses %d phases, following values are related to the whole data _pd_proc_ls_profile_function voigt _pd_proc_ls_prof_wR_factor %.3f _pd_proc_ls_prof_R_factor %.3f _pd_proc_ls_prof_wR_expected %.3f _refine_ls_goodness_of_fit %.3f _pd_proc_number_of_points %d _refine_ls_number_parameters %d _refine_ls_R_I_factor %.3f _refine_ls_R_F_factor %.3f _diffrn_reflns_number_of_classes %d loop_ _diffrn_reflns_class_code _diffrn_reflns_class_description Set_%s%d loop='%s' allow='%s' deny='%s' _diffrn_reflns_number_of_classes %d loop_ _refine_ls_class_code _refine_ls_class_R_I_factor _reflns_class_R_I_number_of reflns _reflns_class_sum_of_I _refine_ls_class_R_F_factor &_reflns_class_R_F_number_of reflns %5.3f %4d %8.3g %5.3f %4d ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS_atom_site_label _atom_site_subsystem_code _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_thermal_displace_type _atom_site_U_iso_or_equiv v_atom_site_displace_modulation_flag _atom_site_type_symbol %-6s BASISCOMPO %-6s %12s Uiso %-12s Uani %6f no yes %s _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 % #8f %-12s # Modulation parameters _cell_wave_vector_seq_id _cell_wave_vector_x _cell_wave_vector_y _cell_wave_vector_z 1 VECTOR loop_ _atom_site_displace_Fourier_axis _atom_site_displace_Fourier_wave_vector_seq_id _atom_site_displace_Fourier_sin _atom_site_displace_Fourier_cos %-6s %-6s %c %d MOLECULAR GEOMETRY?_geom_special_detailsPOWDER PROFILE&'UWVSDžXDžTDžLhAL=_DhAj5_Dj@RDhaDhAh AhAhaDP]D1 ;=_D}p@ uj]&E5P]DjPSb }#t}uO(k@RDB PBPBPBPRhASSbG;=_D} P]D@ t=XDkXD PaLkXD PaT1Dždd;XD]'5P]DjPSa }#u OdadTDDLTTэAPLBPBPAPRQh0AS]a Gd;=XDjDžTDžL5P]DiSP]D@RDhaDh`AFPWDt hAhA hAhAhaD*P]D haD]S`hAS`ǃthA]S`QWDuhAhASH DžHhA5P]D_hA5P]D_h+A5P]Dz_h@A5P]Dj_ hA5P]DW_Dž`fDeDhA󥡀eD\ jDhA5P]D^5eDhA5P]D^hAjh Aj$= jD jDx  hAA5P]D^h`A5P]D^hA5P]D~^hA5P]Dn^ h A5P]D[^hIA5P]DK^hPA5P]D;^hfA5P]D+^ hwA5P]D^hA5P]D^hA5P]D]hA5P]D] hA5P]D]h A5P]D]h@A5P]D]hA5P]D] ٝP;=lD1v`lD;5PlD}z&'lD;5@lD}G&hAWP+hhA5P]D]lD@lD;@lD|ǡ`lD@`lD;PlD|G;=lDgمPd$$hAhA5P]D\hAj9PhA$h Aj=gD~5gDh@A5P]Dt\ =`fD~5`fDhA5P]DR\ hA5P]D?\E@0E@t؍d$$-ٍd$$h@A5P]D[UB rd$$hA5P]D[(MA,@fD+E P$X1E@t؍d$$ٍd$$hA5P]D[UB,@fD+E P$XzE@t؍d$$eٍd$$hA5P]D3[ Mq,h@A5P]D[u hA5P]D[iDـE@t$iDd$$hA5P]DZiDـE@t$iDd$$hA5P]DZءeDh@A5P]D`ZhA5P]DPZeD`1;&WhAhA5P]DZ{tC8tPhA5P]DY { tC 8tPhA5P]DY {tC8tPhA5P]DY hA5P]DYG(eD;Y`fD;XDueDTeDuRhA5P]DAYh'A5P]D1YhDA5P]D!YhA5P]DY$hA5P]DXhA5P]DXhA5P]DX1XdWhAhA5P]DXdLDd$$Ttd$$hA5P]D{X,dTtLDd$$hA5P]DGXhA5P]D7XGdeD;OFeD}Xh@Aj  hIA5P]DWhoA5P]DW= jDt jDx thA5P]DWhA5P]DWhA5P]DWhA5P]DqWhA5P]DaW hA5P]DNWh"A5P]D>W= jDth@A5P]D"WheA5P]DWDž\DždeDkDd;'5kDh}A5P]DV = jDt4 jDx t)d;P A}APhA5P]DyV kDp4譪11ۍ`lD;PlD}t&'lD;@lD}A&'5kDW PhA5P]DUlD@lD;@lD|͡`lD@`lD;PlD|GpkDH$`lD;PlD&lD=@lD~A'5kDjC PhA5P]D^UlD@lD;@lD|̡`lD@`lD;PlD|6&\jkDp4ۥd$$hA5P]DUeD\t&kDx,uhAhA5P]DTEPDljHqDDtADuA9tC֡HqDDt0Dt A9t1HqDD3uWhA5P]D7T dkD@eDd;D\"hIA5P]DShA5P]DShA5P]DShA5P]DS hA5P]DSh*A5P]DShAA5P]DShXA5P]DSDždeDkD d;ot&kD@$8Ph}A5P]D,SkDp4cEPkDp4ңؿ&`lD;PlDt&lD;@lD4]t&'5kDWud$$hoA5P]DR.j@ pd$$4tPh}A5P]DORlD@lD;@lD|`lD@`lD;PlDFG hA5P]DRdkD@eDd;= jDLhA5P]DQhIA5P]DQhA5P]DQhA5P]DQ hA5P]DQhA5P]DqQeD0襥hA5P]DQQ1;=lD1ۉ`lD;PlD}s&'lD;@lD}@&'hAWPhA5P]DPlD@lD;@lD|Ρ`lD@`lD;PlD|G;=lDnhA5P]DPhA5P]DP= jDt jDx thA5P]DcPh A5P]DPPh`A5P]D@PhA5P]D0PhA5P]D PDždeDkD d;ht&kDx,1p8Dž@DžD1D@<1t&`lD; PlD}c'lD;@lD}0<:5kDStFlD@lD;@lD|١`lD@`lD;PlD|G~+5kDhA5P]DN = jDt4 jDx t)d;H A}APh A5P]DN D@P@xPhA5P]DN11'`lD;5PlD}t&'lD;5@lD}A<8t&5kDSPhA5P]DNlD@lD;@lD|͡`lD@`lD;PlD|GphA5P]DMDkDD;P,@@dkD@eDd;hAj h+Ah-AH6 `eDd`;`fDhCAj U5P]D*@P]D HtHM膦$[^_]# %d. %s UVSu] hA5P]DLSVhA5P]DLe[^]%-20s '%s' 'UVSu] j SaMtSVh6A5P]D`LSVhA5P]DJLe[^]% #5f US]QDu SYu"S d$$hAhQD*Lt&jp pPhQDLQD]]ÍUWVS=@RDt\uǃuIG1@RD;5_D}5v'9;uE9Cuu CPDLtF;5_D|1e[^_]cif_format(xnd_cif.c) % #.0f(% #.0f) % #f(%f)% #.*f(%d)$@?&UShAߣE ]uud$$ }EE mE]m]uuEd$$hA~(E d$$Ed$$hAhRDJiS$[d$$5A5AM Ad$$ }UE mU]mEPEd$$ShAhRD)J0mRD]]'cubic'_symmetry_cell_setting'quatratic''hexagonal''trigonal''orthorhombic''monoclinic''triclinic'# %s %s _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz %2d -+%.0f%c%d/%dv?>*?t&??@A&UWVSeDlDE}󫡰lD,A$SAAAA&A&AA&A&AA&A&A&A&A&A&A&A&AAt&AU]EqAUA AUU]EFAUUUUU]E%AUU]AUU]ElDEuElD,A$bAAAAAAAAAAAAAAAAAAAAAhA3&hA%h*Ah6AhAAhPAh]AhAZlDBPRhiA5P]DFhIA5P]DFhxA5P]DF hA5P]DFEEu9uEEE9ElDUEb&'uhA5P]D FE v1ۉ'kuEE@EE ٕ|ـEuٝ|hA ؅uhA5P]DEم|AEu"Ad$$hA5P]DTE؍CxPhA5P]D9E1Ƀ C:EEUL$ME]EE@EuhA5P]DDE]vhA5P]DDE AA}EE mE]mM DžlșlƅulÅullQhA5P]D:D ~WhA5P]D!D ؃},u PhA5P]DC E}EEE0lD9EEEU9UfEM9M7hA5P]DCT[^_]cif_search_bonds_geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag # unitary cell content of %s .%s %8.3f %8.3f %8.3f %d_%d%d%d%s(%c%d_%d) %8.3f %8.3f %8.3f %6s %6s %6s %8.3f ? '_geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_site_symmetry_1 _geom_site_symmetry_3 _geom_angle _geom_angle_publ_flag %6s %6s %6s %6s %6s %8.2f ? o:?>*?t&@@<@?9RFߑ?f@&UWVSDž hVAQWDufhIA5P]D@hgA5P]D@hA5P]D@hA5P]D@ hA5P]D@hA5P]D@}t5eDhAu@ eDlDDž<}󫡰lD,A$AAA AAACAAA(AAAAAAAAAgAhAU]Dž<t&hAUt&hA hAUU]Dž<LhAUUUUU]Dž<(lAUU]pAUU]Dž<lDDžLu DžLeD<lDk0PW?eDP=?Dž8eDkD8;-t&'kDp4Ò1ۃut&'SjC~ $89 |&ʉk0P>k  kDGGhAG$P>1ۃW E'C~1ۍG ؍t&'C~}EuwEugEuYEuOEuAـEu3d$$Ed$$Ed$$7hAu =$DžPDžHL9PL&'lDTDžD&1ۍEۅHt&TMD MDMD$C~Dž@gDž0@&E䋍D)ۅ0UxADž,t&'E苅D(ۅ,UxADž(t&'E싕D*ۅ(UxA[$ 9B; }Ek0G eGeGeٝXمXdAEuу9 |&Љk0Pb;k  kDDOHGlDP[D@PЍT0u&,u(uRhAG$P: 0(P,P0PRh"AG$Pe:1ۍW EC~1ۍwMU'$0C~}EEEu|EurEudـEuVQWDuMd$$Ed$$Ed$$@w-u+P7h@Au190((g,,00@<9@DT0lD9DPDžHL9P8kD@eD8;QWDDž8eDkD8;uU䉕t&'8 $k01ۋD C~$@@ 9uM䉍&k@01ۍW $0C~VtPVf AEtYE@t؍d$$Hٝ\م\d$$G$P75kDh`A5P]D6@ 9@38kD@eD8;QWDhA5P]D6hA5P]D6hA5P]D~6hA5P]Dn6 hA5P]D[6hA5P]DK6h A5P]D;6hA5P]D+6Dž8eDkD 8;B 8$k01ۍU䋍D 'C~Dž@ 9@t$9@uk@01ۍuO Ut&$0C~EPP*ٕ\ AEم\E@@4 9'$94k40 1ۍdH U䍶'$0C~ꍅdPPgٕX AE<مXE$1ۍuO P t&$0C~EPP AEـEم\إXݝم\؍XE@t؍d$$ܽ Aٝ`م`d$$U5A-Aٝ`م`d$$ $PG$P 25kD7h@A5P]D3,4 94)@ 9@a8kD@eD8;hA5P]D222[^_] $Id: xnd_lst.c,v 1.6 2003/07/16 15:05:55 berar Exp $ 'UWVS1eD`lD1ۡlD8~p$PRDƃlD(Ct9|؉e[^_]Printing cycle results # variable (o) value sigma shift shift/sigma CIF filew# file used to generate the cif structure # it appears only if xnd was interrupted # or followed by cif data in tests (prt_cif=8) # -------------------------------------------- EXPER : %s %s PHASE : '%s' %s&' %d shift(s) wil be shortened due to non-linear boundaries in vars at pass %d UWVS] uEhB谈dDPWD@vZhyBhBhaD蘐P]DhBPt/hB5P]Dd/h B5P]DT/$h`B5P]DA/EPRD CuuV41E@VD`VD ;=gD`VD}th BPhB5 ^D.`VDPRDǡ`VD PRDǡ`VDPRDǡ`VD PRDǡ`VDPRDǡ`VD PRDǡ`VD tPRDǃE`VD M; gDEfDeDweDX}th BPhB5 ^D-eDPRDǡeD PRDǡeD PRDǡeD yXu \eD0t0 PRDǃeD,PRDNjeD\ jD`tDt;1`;}C&s PRDǃF(eD;|eD$PRDǃeD( PRDNjeD 1kD;}et&kDp4PRDǡkDx,tp8 PRDǃkDx0tp<PRDǃFkD@eD;|eDH PRDEeD‹M;&'1PMkDL;4}2kDp4PRDǃFkD@eDLM;4|СkDx,tp8PRDǃEeDM;|eDt4PRDǃeD}@EsPRDǃEeDM;|ڡeDDEU;'&s PRDǃEeDU;|t&;t&eD tu|1eDkD;}-vkDp4 PRDǃFkD@eD;|֡eD8PRDKeD8 PRD5eD$PRDeD$ PRDVǃEeDdE;`fDz1=PRDCtGt U; _D~PRDCMMuWhB2 E&5 ^D )`5P]DP]D{e[^_]prt_u_equiv(xnd_lst.c) PHASE : '%s' at %.3f b33b22b11U11=U22=U33U_equivB_iso %6s %7s %7s %12s %9s %9s %9s b12=b13=b23=0 %6s v' %7.3f %7.3f %7.4f %9.6f %9.6f %9.6f U23U13U12U33U22U11 %6s %7s %7s %7s %7s %7s %7s %7s %7s %7.3f %7.3f %7.4fEC; _DhB5 ^D W u e[^_]distrib?}:-DT!)@&U0WVSeD~ eDߋhgBjVHE]D hDeD8+t1ۃ9}StEC9|졀eD8p@19t&ؙEE uD$)t&G9u dDd pB]EE]ExBEu+ B]؍d$$MuE UEE UEC9Nue[^_]prt_rdf_peak(xnd_lst.c)xnd_rdf.dat&#RDF '%s' at %.3f # r rdf_sum rdf_0 %5.2f %8.3f %8.3f ?-DT!)@࿐&UPWVShBMw]D hDPVDeDآ  hDE<]@]@]@ ]9rjr`BMu}EE mE]mhBh Bcǃt"PVDd$$5eDh BWEE9E hBM]t&EMUE]EU]È@~]ԡeD8dq11ۃ;u}c&S r]CPq]CPqEe pBɍd$$dME]ԃF;u|E]ԅt,EЍd$$Eԍd$$E̍d$$hKBW EE9Et Wue[^_] $Id: xnd_pro.c,v 1.4 2002/07/09 06:27:11 berar Exp $ t&9RFߑ?&U0WVS]DfD5VDpjD@iPp]Eu t&B[DjD_D%XDMX@iPkp_D%XDɍd$$jDX5 bD~o j,p]Eu t&B gDjDE [D@Xjo [Dd$$ejD@X`VDЅyB)‰ЃtXjo]EuBYDjDE@Xjeod$$jDjD% [DBɍd$$E@t؍d$$ YDYDjn]jn]jnjDE YDE YD YD@Xjnd$$6]jn YDd$$]$j}n YD YDd$$jDEE@X1;=eD}jD eD&G9|=hD5]DNmtm11;=eD}at&'Vm]FPm]FPmjD E [DE5_D gD G;=eD|]D hD0bD`DeD$l1MjW]k, ]DPX kPAm ـE@t)E5cD0bD0bD ]D@ X k@PlـE@t*E5cD`D`Dk, ]D@XkPlـE@t*E _D0bD0bDk, ]D@ X kP]lـE@t*E _D`D`Dk, ]D@XGeD;jD0bD@X0bDBu`D5`DYjDBZBEuZ؋jDBEu/CE@t؍d$$w[ jDX1eD;B$ejjW}]eD(Jj1;5eDk E܍vE ]DXeDPjـE@t,jD E ]D@X؉eD@PijـE@t8jD E _DE ]D@XF;5eDGeD;e[^_]Ív}:UjDBBkDjDpjD`jDBBEuBEukB>1LءjD@BEu ?t&=[DtG9=hDu t ]Ðt&UhDttK`jDttmtta AS>L6CE<`jDtt-t&kB?<P$X]jDMjDЉ]Ðt&UShDtI4t&=`jD*`jD$ B&#B B@!B!BP"Bw@ kDjD kDhD@ kD\D`_D1;eD]D0kDjD B;eD|= kDjD kDhD= kD`_D\D1;eDA]D0kDjDv' B;eD|5 kDjDjD kDhD5 kD\D5 kD`_D1;eD]DjDjD0kDt& B;eD|xkD kDjD kDhDlD kD\DD kD`_D1;eD(]D0kDjD B;eD|`jDtF t )t&`_D\DhD&?P$X kDjD kDhD?P$X kD\D`_D1;eDW]D0kDjD B;eD|(<P$X kDjD kDhD<P$X kD`_D\D1;eD]D0kDjD B;eD|k9P$X kDjDjD kDhD9P$X kD\D9P$X kD`_D1;eD}G]DjDjD0kDv' B;eD| t&kD[]Ð The asymmetry functions code %d implies : instrumental uses (H+S)/L ... convolution ' together with odd derivative of gaussian &' instrument and phases use only odd power expansion with gaussian too much asym functions required max(%d) instrumental uses only (H+S)/L ... convolution & phases uses only odd power expansion with gaussian t&U5eDh$B5 ^D  =eDyYhDeDh %B5 ^D h`%B5 ^D jDpPB=[Dt:3hD'hDh%B5 ^D~ jDpPBjh&B=eDPi[hDeDh@&B5 ^D1 h&B5 ^D! jDpPB=[Dt hD] $Id: xnd_prac.c,v 1.1.1.1 2000/05/28 13:19:00 berar Exp $ t&profile table for asymetry convolution'UVS@(B@D @DRD= RDVj5RDvjADVj5RDcjADVj5RDPjAD$Vj5RD:jAD1ۃ ;eD})&Vj5RDjAD C;eD|ߍe[^]def_asym(xnd_prac.c)convol asym needs non ZERO sum of valuesprev_asym ------- p_sum %.3g integ %5.3f (is=%d, ms=%d) instru approxsample approxconvolasym (%2d%2d%2d) %7.3f wasym=%.4f inf=%5.4f min=%5.4f norm=%.4g --> %s %d, t_width=%d }:cܥ<@4Ct&cܥ\@9RFߡ??&U Sh*)B_b]DfD`VD]j>^0SDj1^`SD 0SD@SD0SD%@SDPSDh@)B0SD8*BEPfcDty=ZDup=hDg=SDu =SDt35SD5SDADd$$ADd$$h)BfADADSDSD[DRD@SD@*B RD]ERD0SD RDRD[DEu+jDEuRDءjDRD=ءjDH*B RDEuRDءjDH*B RDEuRD0SD]P*B RD RDE@t؍d$$\M%RDRDSD@D RDkDEu2)BjDDBkDEBX*B=RDRDt@D kDRDEu")BjD?BkDCB6t&)BX*B=RDRD[DEujDp8BkDp0AD kDjD kD=0AD kDj0AD kD1; eDAD0kDjD&'8 0A; eD|iADADADAD1; eD}PSD]EBgDgD0SD-gDgDW&ERDEu;0SD]EÈ@s]gDgDEhDhDE\D\DE`_D`_D1;eD}.0kDeD&'EB9|RD5SD hDhD5SD \D5SD\D1;eD}/0kDRD5SDeD B9|RD5SD gDgD5SD gDgD9D]̉]profil_asym3(xnd_prac.c)?t&U0VSh.IB~CcDtSDSDpSDfD5RD}EE mE]m]RD\];RD|RDK@v')P$X RDURDEucE]ࡴADD PSD] HIBE RDE@t؍d$$袤M5RDE]E5RDE@t؍d$$^]EERDEuAD PSDAERDEu=0SD]EـÈ@rAD E]KRD5SDM]3BEe[^]Ív?@&U0WVShRe[^_] $Id: xnd_pras.c,v 1.1.1.1 2000/05/06 08:28:00 berar Exp $ t&@@A;A@@AM$A@A47A[A`iA@t^A@@@@@@AAuA`@@@@@@p@A@@@@d@^P@~@@ @(@0@H@t&@U0WVSfD5kDUUd$$գ]E䡐eDH$PB`RB0RBQBQB@QBPBE OB-(OB-0OB-8OB-@OBHOBDkD POB-XOB-`OB-hOB-pOB-xOB]E OB-OB-OB-OBOB@kD OB-OB-OB-OB-OB]E OB-OB-OBOBU fD5pjDUjDUd$$d$$]=dD=hDPkDE jDEM5pjD]EkDfDEu kDEeBd$$uuCe PkD5eB5pjDjDE PkD]EjD] UkD]Ð?UkD fDjDjDH fBjD@]?t&UjD gB]Ðt&9B.@m0_??UjD@]8gBE@t؍d$$k}]EpjDjDxjD@gBH$5pjDPkDPkDHgB pVDEu1upjDjDE@t؍d$$چXDPkDpVDEuHgB XDXD`jD] $Id: xnd_rato.c,v 1.5 2003/04/10 15:37:31 berar Exp $ OcRKzKyKxBisoZYXb23b13b12b33b22b11C_OcS_OcC_zS_zC_yS_yC_xS_xC123C332C331C223C221C113C112C333C222C111D3312D2212D1123D2233D1133D1122D3332D3331D2223D2221D1113D1112D3333D2222D1111E22333E11332E11223E33312E22213E11123E33322E33311E22233E22211E11133E11122E33332E33331E22223E22221E11113E11112E33333E22222E11111F112233F333221F222331F333112F222113F111332F111223F222333F111333F111222F333312F222213F111123F333322F333311F222233F222211F111133F111122F3312F2212F1123F222223F111113F111112F333333F222222F111111'UEu1ɍ&']EtEu/ ʉ']EEt؉]É?UE]EkBEu]atom_mult %s sym %d (%6.3f )%c %s inv*%d v?t&MbP?H@HUWVS] Dž|hkB lDlDt҉E}󫡰lD,A$lBvlBlBlBmBmBmBmBmBlBkBU]EV&kBUt&kB kBUU]EkBUUUUU]E= jDP jD lD,A.$UmBmBmBmB|nB|nBmB|nB|nBmB&B71vE@u?B(E@u(BE@uBE@kB]BE@uBE@t kB]E@uBE@t kB]E@uBE@t kB]܋ElDUEeMx1&'EEUD HDHD$d$$EF~}t:Ed$$Ed$$Ed$$u5kDhkB5 ^D(EM9M&']}thkB5 ^Da1] ؉'UDd$$GU}td$$hkB5 ^DEM$d$$EUF~kBE|lDEU‹ExE@u E4Ex=lB}ME mM]mEMk0kE0lDM< }t1EkBE u=PhkB5 ^D EE9EtlD}tu5kDhkB5 ^DEt&]}thkB5 ^D1؍EEEd$$pU}td$$hkB5 ^D9EU$d$$EUF~}t0kBE u=PhkB5 ^D EkBE|UUlDUExE@u E4Ex=lB}ME mM]mEM1k k} 5lD9EA~EU9UZ}thkB5 ^DEE0lD9EP|d[^_]atom_sym%d/%d0xyz?t& special position (orthorhombic check : 3,4,6 axis ignored) %d : %s, %s, %s %s symmetry study (DON'T USE, needs to be validated) wave symmetry (%cT%+d/%d) restriction : S_%c C_%c for 1q and 2q none for 1q and 2q not allowed for 1q for 2q unchecked S_%c C_%c for 1q for 2q unchecked summary (Sin,Cos) : (1q) x(%c,%c) y(%c,%c) z(%c,%c) (2q) x(%c,%c) y(%c,%c) z(%c,%c) {Gz?H@&U`WVSu 1h#sBlDPju1ۃ'tBjuuEPV;E}  %tBC~EPEP6.) }tuuh,sBEPUh2sBEPBEPEPv( }tuuh,sBEPh2sBEPEPEPv( }tuuh,sBEPϽh2sBEP趽$qvBvBvBvBvBvBvBvBvBvB4sBt&E6sB8sBK4sBEU8sB6E&4sBEUM4sB6sBM :sBщQRPWh@sB5 ^DμI}?j j1EPuhsB5 ^D虼EE;EUUt&'ME<lDEӍ9E}U]E]UME<t=uB]E]uuzm]EԍEPEPd$$&hsB5 ^D读j kE0EP5 ^D^((EE-u+PhsB5 ^Dl }tuuhsB5 ^DMhsB5 ^D:EE}}11učkEUEu3]00D0D0D0CxPPhtB5 ^D辺GC~h tB}}11uĐt&kEUEu)]00D0CxPPhtB5 ^D;GC~th5tB5 ^D11uč&kEUEu*]D0D0CxPPhtB5 ^DǹGC~hJtBhStBt&}11u kEUEu!]00D0CxPh_tB ]D0D0CxPhetB5 ^DG C~htB}}11učt&kEUEu^0CxPh_tB]D0CxPhetB5 ^D茸G C~thktB5 ^Dn11uĐ&kEUEuD^0CxPhetBD^0CxPh_tB5 ^DG C~thttB5 ^DhkBh|tB5 ^D۷EE;E]EPEPEPEPEPEPEPEPEPEPEPEPhtB5 ^D}8e[^_]atom_site Using %s, %s generates %d(%d/%d) sites corresponding to %.2f(%.2f*%d) atoms in the cell The chemical occupancy is then %.3f %s don't generate (%d/%d) sites for the %.2f(%.2f*%d) atoms in the cell t&U WVShq|B]lD%Ehq|BlDPjpEhq|BlDPj`QǡkDp4B  j ]1ۃu'S d$$C~uWuEPEPÃ}tuh{|B5 ^D脵 S$[Md$$uEd$$EMd$$SuEP5kDh|B5 ^D749]t"lD%tu WuEPSDhkB5 ^DEEAvuEd$$EMd$$Su5kDh }B5 ^D踴E(W谴u訴Ee[^_]check_dif-_t&UVSuhNBk kD@@@@@ @ lD%f2sBfEVEP]UHqDDtt&'CDujS}=¡kDP lD%tS?¡kDP eDtK&jS5=¡kDPlD%f2sBfEVEPV]UHqDDtv'CDuUHqDDt]]jS<kDBlD%tYB$tSfXBfEV]SҳjSv<¡kDPu&fZBfEVS訳jSL<¡kDPeDtE$jS%<¡kDP e[^]fget_atom(xnd_rato.c)atomsCONVERTCASECHEMNAMEATOM %s %sv' No keys, Atom name and species not found %d 'B_ISO=b11 to b_ANISO' %d:(Unknown case B_ANISO B_ISO MAGNET MODULATED=%d B_ANHARM3 anharmonic expansion is only valid for simple case B_ANHARM4 B_ANHARM5 B_ANHARM6 F_ROTAT free rotator applies only valid for simple case)&'magnetic or modulated atoms are not allowed in rigid bodyCOORD 'B_ISO=b11 to B_ANISO' &conversion from B_ISO to B_ANISO needs variable order=1...t& B11=%6.4f B22=%6.4f B33=%6.4f b1=b13=b23=0 MODULANHARM3ANHARM4ANHARM5ANHARM6?U0WVShvBEhBj@ukDE1;uk]&'=kDjF f¡kDfPjjURjhBuURjhBhBSjhBhBPjhBjhB]PuKS5kDhB5kDhBPt } tEPhB5kDï S5kDhB5 ^D虮}thB5 ^D耮M}  uhB5 ^D\kDEB$h B}P kD@(Et@( hBh$B5 ^DEt'kD@(lD%h,B5 ^DحkDEB,t!lD%r,h5B5 ^D衭 kD@0E t@@0hDB5 ^Duh`B1Eu kDx,tR E@tBkD@0hB5 ^D-h`B1Eu kDx,tR }yBkD@0hB5 ^Dh`B1E`u kDx,tRc Et6kD@0hB5 ^D蝬h`BkDx,P' Et>kD@(hB5 ^DbhB1ҡkDx,ux0tR hB5 ^D,} t&h B1Eu kDx,tR S{EtjjjhZBhTCDjjjhZBhCDkDPjjp(¡kDP4$}h`B5 ^D蓫hBkD@4x P ءkDp4j_ B]EkDB4@( cDXB4@( WDXB4@( gDXB4@(PB4@(P B4@(X$jd$$jd$$jd$$hB5 ^D軪Bo]'ShQB5kD[ t]]read_remark(xnd_rd.c) %[#] UpWVSufEEhBhEEv'5kDjd}EP萦5 ^DW|=[Dt5[DWdfEh=XDt5XDuDLvtE]߹)M>tu6迥SP6u补uP uhB5kD 3~Ee[^_] Using system tmpfile for %s xnd%s_%d.$$$t& Using '%s' as temporary file for %s w+ No tmp file found in %s 'UWVSu }t}uYuhB5 ^D2@SVۤuVh B5 ^DhFBV蜤|hBuV"1 \&WVhBSEPSݤuȤ8zG~uhIBFDp 聣uVj D[^_]clean_remarks UShsBBlDЃ *t31;*})t& *<t 4ClD;*|ۋlDЃ$*t/1;*}%$*<t 4ТClD;*|ۡlDǀ*']]Reading Usage : '%s [-s] coord_file' %s Coordinates file ? xnd_doc.d.%s : %s [%s:%s] %[^ ] %s : %s [%s:%s] r.kcoordinatesE_FOPEN Failed in opening file '%s' : '%s' E_HDR Failed reading header in opening file '%s' : '%s' xnd_dif.d if needed '%s' will be searched xnd_sym.d Reading %d symetry group(s) Reading %d anomalous tables Reading %d diffusion tables datafileremarksNo experiment to readexperNo phase to readphase%f %d %*lf Marquardt parameter is invalid %f, modified starting value of the Marquardt parameter %.3g, decreasing by %d/10 Size of temporary data file : %s %ld ko %d variables (%d parameters), %d cycles allowed swap filet&Size of temporary swap file : %ld ko vecteurmatriceQ9t&UWVS]u [DYDXD]D0hDFD@ ^DfDh@Bh0*jlDǸ `B\D tDlD(*lDL'P hBlDh)R(Pt+lDBL'fBf(fBfh)tq~ tovzPzPzPlDL'PhB{PlDL'PW֝ h \DhB謞 \D&~!~F8-ujsPZt\D=\Dt*jzP4zPzPlDL'PhBdWlD(Ph͑BlD(P賝kDukj.lD(P՝u2hϑBlD(Pɝh͑BlD(PdkD=kDuWhґBhB˜j Ԝ5kDhhWDR9q u&[ulD(PWh Bj 舜=fDt~|udh]BlDh)R&PTlD&PhB5 ^DhBlDh)R%P$lD%PhB5 ^D軛lD`D `Dǀ%@fD _D_D]DbDWDǀ%ǀ%ǀ% lDt&F~5 ^D lD%%hB5 ^D1 {=fDthߒB5XDÚj5kD¡lD`" %t jRg =fDtlD`"4y FlD;%tlD%t'%hB5 ^D,j&lDǀ,*lD%%hB5 ^D1 ljj5kD !¡lD@ %t5 ^DR=fDt5XDlD@4FlD;%|5 ^DQjF@[DtPh͑B@[DtPhFBh \DǙ)@[DjhBh \DlD(P Poh'BhZDlD(Pb[Dh/B=gDPUhEBh 5gD@VD`VD1 ;5gD}9'`VD?¡lD %F`VD ;5gD|hKB=`fDP`fDXDh\BhdP^fDeD1;5`fD}#&VJ2FeDd;5`fD|jf WDbD[Dh[DhbDhbB5kD跘bDEu2d$$hB5 ^DxؔBbD[D 5[DbDd$$hB5 ^D8j%fgDlDWD%%ky @Ph \Dh B5 ^D(5bD5 _D5_Dh`B5 ^D蹖=bDu  _D _DA@YD5p[DQlD%à tBhBh@^DlD(PP؅y PhB5 ^D1lD%t,*5lDgD= _Dt:dDhƔBj5 _DaDhΔBj5@YDVD=bDdD=XDt5XD5kD֕e[^_] $Id: xnd_rsym.c,v 1.3 2002/05/02 12:43:28 berar Exp $ }:@Bt&?U WVSE}E BEAEu BȞBd$$S BȞBd$$X}UE mU]mEM 0U ©u1t&M utӋE EþVUUUщ)k9uvы)k9u`v'ى)‰ЋU )U )‰k9u)‰k9t؍e[^_]fprint_xyz_pos(xnd_rsym.c) %+d+%s%c-%c%d%c/%d, %cv}:&U WVSEEEhPB lD*u EE@EhkBuE} 1;] UBEEPEP4 ;]u uhnB1}uCXPsBtrBPhuB,}uCXPhzBuE t&CXPuh~Bu(}tuhBu 1C;]DEH9EthBuEE9EEPhBuÑBe[^_]print_sym(xnd_rsym.c)CubiqueQuadratiqueHexagonalRhomboedrique/HexagonalTrigonalOrthorhombiqueMonocliniqueBMonocliniqueCMonocliniqueAAnortic=triclinique Symetry group '%s'(-x,-y,-z) * NotCentered& %s system %c (%s) holoedric %d, %d %s, %d operations & Complement de symetrie pour structure modulee '%s' %s %c dimension %d, (%d) %d operations #%2d UWVS}u h(B *,A$BBBQBBBBB`BBBBBBBwBBXBgBBpB>BDFB=RB5\B.tB%}BBBBBtWhʢB5 ^D+ PBuޢBPPPSPGPhB5 ^Dߎ$OtWh@B5 ^DŎ PPPPGPhB5 ^D莎=lD~=t&ShB5 ^D[j V5 ^DC49|hB5 ^D$e[^_]new_sym(xnd_rsym.c) %s #%s %c %d %d %d UWVS}hǥBPPPPGPWhۥB5XD褍=lD$~Ot&'؅yC)‰Ѓ t;PV5XD C49|hB5XD(e[^_]analyse_xyz_pos(xnd_rsym.c) Group '%s' unable to understand '%c' (%02x) in '%s' reading symmetry datav A@Bt&U WVSEEhæBoEE}H=v EƀuhuU]EEEFӡHqDDt?}uE DBR$Z%HBE DBP$X%HB]s/u'EE@u]Ev+-~BZXÃXE}EE@u]E}t Eu]u}}EـE@t EɋE ؿU]E-Eu},ueE`t& tV tQ}tuhߦB5 ^D詊 uPPhB5 ^D莊h+BEEP`}t Eu]u}}EـE@t EɋE E9E}1e[^_]%sread_sym (xnd_rsym.c) %[CQHTROMNLA*] %d%d%d%*[ ]invalid data in symgrp header '%s'Unvalid 4-dim symmetry complementsymgrp %[^; ]%*[; ]' reading group structure from %d generators vUWVSDž@Dž< Dž4ƅujxP蜉 E@  u'F> t>#t> t> t>tj#P\Ht]ShѩBVhԩBOSIdPhBuAdO `P\PXPhBu ǃE@ tl1|t&EPh B1~` `uPP}H vƅEPUሕN*u4O*uX@@X<h`BjHthH@P,P[ ƅ,`H<`PhBRj4PjPbDEP4z h,P4PԇO4XN\`<18 ;`&ShBu @48SXtG8<8;`|E`ډDRhB5 ^D蛅hB<DSj0SjPDž$hBSjSjP訅Dž`108;D&ShBu @48SXt8@0``G8<8;Dr<`PhBPj4PjP諄bDEP4 h,P4P`O4X4N\`<81 ;@}'萍t&@Ǎ88G;@|Dž @@@P8(108,DžTS1; }CPt&($,@cF(,; |TT;|(+8ЙP G$P$;DB0苂耂4[^_]get_sym(xnd_rsym.c)SWAP_COMPOrxnd_sym.dOpen sym fileInvalid LatticeNo SYM : %s found in %st&'UWVShBuuB 8u 01;bD}-u4lD`"4`t]C;bD|hBhB ƃuShBhBlD%PRơlD%P8PDt&lD`"UBB8B0 %d atoms, distribution is must contains %d for each atom : %d values compton uncoherent code %d implies : %s nb_atom <= 0 uncoherent > 1 abs(nb_dist) < 2DISTRIBDIFFUSEUSjjeDRjh/BjRjh5BjPjh:Bjh?B1)lines must be defined (>0)CELLHKL'US]eDǀǀǀǀǀURPhB5kDiueDh B5 ^Dg h@BeDPWhcB}PBt@jjjjh8EDh~Bjjj¡eD $hvB5 ^DZgujj¡eDlD`ǀ T t'eDǀjjjjjhBjjujjjjhDEDhBjjEP¡lDP$1]]read_phase(xnd_rpha.c)amorphe(reserved)magnet+modulmodulationmagnetquasicubiqueparasiteradialhkl_genereshkl_lusORIGTRANSITNATURETITLEPHASE%d%d%f %[^@ ]v PHASE #%d : %d (%s), %d T transitions, origine du developpement :%.3f '%s' PHASE : '%s' SCALEt&'U0WS]hB蛾E,BE>BEKBEVBE]BEjBEsBEzBEB=eDY󫡀eD٘ j%eDfj PPjhBjEPjhBjPjhBh0BRjhBjhBTuDeD RURPhB5kDe(5eDhB5kDe eD~eDPـ d$$u؍U4ShB5 ^D@d$=\Dt5eDhBTdeD~ǀt&1eD_Djjjjh$EDhBjjj¡eD$jjjjh,EDhBjjkEP¡eD$hvB5 ^D|ceDt- t6;t&t u-!/j#j& WcieD_D+脼e[_] $Id: xnd_rexp.c,v 1.4 2002/06/19 09:57:29 berar Exp $ WgT-tWlT-tInt.LamdaAbs_plAbs_cylAlphaS_EclTmonoPolarZeroMuAlpha_cWgS2aWlS2aWgSaWlSaWg_T2Wl_T2Wg0Wl0AS2A_TA_T2D_H+SH+S_LResol\yčUSB]PVD]@]]SPVD@]@]S]]Verif data_fichR?{Gz?&US]Sph'B8Bm@BEPE]PVDEXS2h'B8Bm@BEP軾PVDEXEXE]]pseudo_data(xnd_rexp.c)TEMPSTEPSTOPSTARTDATA%f%f%f%ft& PSEUDO_DIAG : T = %.3f, start=%.4f step=%.4f stop=%.4f step lower or egal to zerono points between dtheta0 and dthetaf with such stepv ApB=m&U WVShBE`VDU;EE'PVDXAPVDBXBXB]jPVDRRjhBuujhBBPPjhBRRjhBjh BLu$PVDPRuPRPhB5kDB`PVD@d$$Ed$$@d$$d$$h B5 ^D^(hYBEBÈ@PpPVD@`ud$$}EE mE]muhBP%PVD@]U]1ۃ9} }W蚤CEE]9|DPVDplD%@;%~%EPVD`VDU;.ye[^_]read_exper(xnd_rexp.c)WEIGHTORIGBGROUNDLAMBDAFILETECHNNATURETITLEEXPER %d%d%d%d%d%d%f %[^@ ]XRayNEUTRONSRX_ANOMALNEUTRONS MAGNETIQUESsingle crystalpowderReflexion SymReflexion Assymt&Reflexion fixed incidence angle, linear detector ???t&'Reflexion fixed incidence angle, curved detectorTransmission SymTransmission Assym ???&Transmission fixed sample, linear detector ???Transmission fixed sample, curved detector ???Reflexion (absorption corrected)Reflexion (absorption corrected) with fixed incidence angle, linearReflexion (absorption corrected) with fixed incidence angle, curvedSIMULATED PATTERN 2th i th 2th i 2th i s th 2th i sexRAWDBWLLBILL_RTVDMI_RThkl Fo Sohkl Io So???s' EXPER : %d (%s,%s), techn %d (%s) %d data set%s : file%s type %d (%s) phase_ref : %d, hkl_dim : %d common to diagsfor each diagv wavelength : %d, background : %d (* %d points): %s t&' T_orig in expansion %.3f '%s' EXPER : '%s' : %d data set error reading experiment header keys=%d && args=%d!=8unknown experimental natureunknown experimental setupExperiment without data setpatterns SETTINGINSTRUASCNVASYMC_EXP #<&U WVShB譱=`VDCj胲`VDfٚٚjPPjhBPPjhBjPjhBjPjhBjPjh BjPjh#BjPjh(BjEPjh.Bh5BRjh6BjhB5B.B% BBB#B-B`VD5B~1B`VDWDWDfǂy~ffQ`VDSSVuuuh@B5 ^DS`VD0@t"hB5 ^DSG`VDfBuBP`VDRhB5 ^DS`VDPـd$$h B5 ^DcS=\Dt`VDPhABqS uuh`B1}u }P輰hB1Ƀ}xUЅyB)‰Ѓ~Q茰hB`VD Po hB`VDPOhBh`VDձ¡`VDPVD }t 2tKkwphB5 ^D0R`VD_D295Bjjjh|EDhBjjP*¡`VDǀ$R `lD=PlDlD=@lD~v'1EPt `VDPʦt `VDC`VD;|lD@lD;@lD|`lD@`lD;PlD`0[DwjjjjjhBjjjjjjhBj`VDR¡`VD$`VDjjjjhEDvjjjjhEDhBjjW¡`VD$`VDЅyB)‰Ѓt$5BjjjhEDhBjjj"5BjjjhEDhBjjj?¡`VD$=hDt-jjjjhEDhBjjj ¡`VD$=eD~3jjjjhEDh BjjkeDP¡`VD$`VD譣`lD=PlDvlD=@lD~N'1ۍ&'S芤t `VDC~⡐lD@lD;@lD|`lD@`lD;PlD|-jjjjh|EDhBjjj¡`VD$`VD t15BjjjhEDhBjjj¡`VD$`VD_D+ҧ`VDt& t6t t$t& 1e[^_] $Id: xnd_r11.c,v 1.2 2002/01/10 15:24:43 berar Exp $ get_init_param %[#]%d%f %[^ # ]vUnvalid type in get_init_param, please report!Unable to read initial parameter '%s' (type %d)%[ ]%[#]%cvUWVSEElD*F*h7BϥEEEEE7Et&'5kDjdudMlD *| <tf}ҋ|<ЍEu *4LlD * u *4M<})MucLlD * u *4L 5 ^DuL@EuhFB5kDL ukD@ } t7 } t} t\uhLB5kDhLEE0SuhOB5kDILEEd$$uu5 ^DK >uhRB5kDLEuuu5 ^DJh`Bj>u uhB}P_uhB5kDK uuEhB5kDK tM5kDjdu=K]߹@PJlD$* S$*4JlD$*<t5 ^D4J%&}tEPhB5 ^DI ]d[^_]%s%5d%10.4f %sUnvalid type in new_init_param, please report! %st&'UWVSu] }EElD *<t4hB5XD I t t Jt&t+?6hB&d$$hB5XDH'VhB5XDH h@Bj<lD$*<t4hoB5XDHjt&XDPJPyB;P|+UXD8 t@75XDj I&5XDEPIXDUXDe[^_] %[^ ]wlisting E_FOPEN Failed in opening file '%s' : '%s' get_11hdr(xnd_r11.c) %s : %s [%s:%s] %s Reference : %s %s xnd_1.1x header mode : files '%s' --> '%s' : %s rem0rem1 %s : %d Number of cycle(s) TEST_MODE on : %d TEST_MODE max_cycle TEST prints out matrix and vectors TEST prints out in pseudo-voigt TEST prints out on convol asym TEST get asym parameters %s : %f TEST_MODE asym_rminTEST_MODE asym_rmaxTEST_MODE asym_resolTEST_MODE asym_width& TEST get bragg repart parameter TEST_MODE bragg_repartSymetry group(s)Anomalous diffusion table(s)Scattering table(s)Number of experiment(s)Number of phase(s) %s : %.4f Eps_stopEps_profRelaxation coefmethodback_groundProfilex_back correl.w(y_calc)min.lin.' The method code implies : %s, %s, %s, %s The method code implies defaults interpolsplinepolynomial???, printing uncoherent, adding uncoherent The background code implies : %s%s%s pseudo The profile code implies : %svoigt Asymmetry functions codeParameters expansion ordervalid_refPrint symPrint difPrint correl NEW file %s : '%s' NEW nameNEW file is the same than the coord fileTo much init_param to read, please reportE_CHK Internal consistency : %sHKL fileHKL namePLG filePLG nameadd_semicolumnadd_endrecordno_header plg_code implies : %s %s %s valid_ref non nul ==> affinement restreint : 1 < code < 10 : (code - 2) modulo %d == %d ==> codes affines %d, %dxx v' Printing non calculated lines : prt_hkl = %d disk_dydpdisk_datadata nametmp_defaultdata_pathtmp_patht&UWVShhDhB5kDA5 ^DhBhhDA ^Du!hhDhBhB@j @hBFhWD|PP@P PPlDL'Ph@B5 ^D@(5@]DhhDlD(PhBlD1ǀ*hBjj(¡lD *hBjj(¡lD$* *(lD$*((j hBhBjhbD^=bDbDأcDPhB7j hBhBjhbDcDt hB cDt h@BcDt hBݜcDtphBǜj hBhBjh@Dj hBhBjh@D,j hBhBjh@D|j hBhBjh @Dd(cDt2h BNj hBhBBjh@D6 cDj,hBhYBjlD%Pj,hBhjBjlD%P(j hBhBjlD%Pj,hBhBjhgD(j hBhBjh`fDj,hBhBjhpYD~(j,hBhBjh`Dcj hBhBjhgDK(j,hBhBjhpcD0j,hBhBjlD%P(j hBhBjh[D=pcDtkpcDBtBPpcDBtBPpcDBt BPpcDBt*BPh@B5 ^D<hB5 ^Dl<lD%ƒ0[D `DЃtt)ttBBBB`DBtBP`DBtBPShB5 ^D;=[DBu'BPh@B5 ^D; gDـEugD pcDj hBhfBjheDnI.j,hBhBjlD%PK(j hBhBjhYD0j,hBhBjlD%P(j,hBhBjlD%Pj hBhBjh_D(hB5 ^D:j hBhBjhfD=fDtLfDj hBhBjhcDhBlD(PhcDF;P=cDuh@BhBPԗ j hBhBjhaD=aDtj hBhBjhbDj hBhBjhVD=VDtsj hBhBjhdD=VD~OVDBtBPVDBtBPVDBtBPhB5 ^DZ9hB5 ^DG9=YD~V lDfDyؙ=YD%lD%R%R%5YDh@B5 ^D8aDtPhB5 ^D8 j hBhBjhp[Dj hBhBjh@[DB \D(=@[Dtj hBhBjh \Dkj hBh BjlD%PJlD%tj hBhBjh)P lD%tj hBh#Bj(PlDB(hB5 ^D7Je[^_]%s %s t&US1hBhBhcD裘XDhhDhWDh%BPu7=cDuj jjhbDcD؉Ej SCjEPj SCjhbD cDtFj SCjh@Dj SCjh@D j SCjh@Dj SCjh @D cDtj SCjh@Ddj SCjlD%PKj SCjlD%P5 j SCjlD%Pj SCjhgD j SCjh`fDj SCjhpYD j SCjh`Dj SCjhgD j SCjhpcDj SCjlD%P j SCjh[D=hDuj SCjhhD j SCjheD`j SCjlD%PGj SCjhYD7 j SCjlD%Pj SCjlD%P j SCjh_Dj SCjhfD j SCjhcDj SCjhaD =aDtj SCjhbDj SCjhVD=VDtj SCjhdDwhB5XD4j SCjhp[DTj SCjh@[DD(=@[Dtj SCjh \D(j SCjlD%PlD%tj SCjh)PlD%tj Sj(PhB5XD4蔍]] $Id: xnd_r12.c,v 1.3 2002/05/02 12:43:28 berar Exp $ get_12hdr(xnd_r12.c) %[@#]' %s : %s [%s:%s] %s Reference : %s xnd_1.2x header mode %s .lst.new.hkl.plg.cifCIFHKLPLGNEWLSTDIFANOSYMEXPERPHASECYCLEXNDrem0 wlistingE_FOPEN Failed in opening file '%s' : '%s' files '%s' --> '%s' : %s %s Number of cycle(s) : %d Number of experiment(s) : %d , Number of phase(s) : %d Symetry group(s) : %d , Anomalous diffusion table(s) : %d , Scattering table(s) : %d Current files names are : '%s' (new coordinates), '%s' (hkl intensities), '%s' (plot) VAR_MODERELAXPROFSTOPASYMORDERPROFILEBGROUNDLSQMODES The method code %d implies x_back correl.w(y_calc)min.lin.: %s, %s, %s, %s defaults interpolsplinepolynomial tthq-2 polynomial expension???, printing uncoherent, adding uncoherent The background code %d implies : %s%s%s pseudo The profile code %d implies : %svoigt Parameters expansion order %d KEYCOROUTPUTNEW file is the same than the coord file The new file '%s' will be produced with serial number #%d t& prt_new =0 : No NEW file will be produced q_stepsadd_semicolumnadd_endrecordno_headert& The plg code %d implies "%s %s %s" option(s) in %s t&' prt_plg =0 : No PLG file will be produced Printing non calculated lines The hkl code %d implies : %s prt_plg =0 : No HKL file will be produced Data for cif will be generated in '%s' cif file '%s' will not contain standard deviation : cycle = 0 PATHTMPDNAMETMPDEFDATADYDPVALIDOTHERS valid_ref non nul ==> affinement restreint : 1 < code < 10 : (code - 2) modulo %d == %d ==> codes affines %d, %dxx BRG_RATIOAS_WIDTHAS_RESOLAS_RMAXAS_RMINPRINTTESTtest : print & 0x01 -> prints out matrix and vectors v'test : print & 0x02 -> prints out in pseudo-voigt 'test : print & 0x04 -> prints out on convol asym &' irem > REMARK_PAR, please report!=Y?>?UWVSDžxEhC5kDr,艄5kDb,EPh,C5kD+5kDEP*,*Ɖ5 ^DPPPPtPlDL'Ph@C5 ^D*(hWDh~CvlD(P]S&+j.S+t]ShhD+hChhD'+ShcD*hChcD + ShbD*hChbD*ShdD*hChdD* ShaD*hChaD*EP謃jhaDhaDjhChbDhbDjhChdDhdDjhChcDhcDjhChhDhhDjhCjlD%PjhCj%PjhCjˆ%RjhCjhgDjhCjh`fDjhCj hbDjhCjhCui1lDǀ*hCjj¡lD *׸lD *ExAxhC5 ^Du(FDp hChhD) ^D uhhDhChCn(j w(V)(jjV(F u>] VjjS(u5 ^DjjS(F tV*(5@]D5@hDhhDlD(Ph@C踅lD%%%5`fD5gD5bDh`C5 ^D{'8hdDhbDhcDh C5 ^DY'5 ^DF'lD *xPBx!CpYD`DCgDjj|Pjh{ChgDhgDjhCh`Dh`DjhChpYDhpYDjhCjheDjhCjlD%PjhCjh[DjhCj˜%RjhCjhpcDjhCjhC2ĸ5pcDhC5 ^DR& =pcDtjpcDCtCPpcDCtCPpcDCtCPpcDCtCPhC5 ^D%t&h C5 ^D%lD%ƒ0[D `DЃtt-tt!C C'C6COC`DiCtSCR`DiCtjCRPlD%hC5 ^D#%=[DiCuCP5[DhC5 ^D$lD%hC5 ^D$|4 aDVDfDlD *xPBx}~jjhPWDjhC5FDhFDjh!Cjh_Djh%CjlD%PjhCj%RjhCjhaDjhCjhVDjhC5fDhfDjhCjh)CĐ=fDtQfDh@ClD(PhcD$P]5fDhcDhC5 ^D#hC5 ^D#=VDtqhdDVDiCtCPVDiCtCPVDiCtCPVDiCtCP5VDh C5 ^D# h`C5 ^D"=aDt4aDiCtCP5aDhC5 ^D"hC5 ^D"PWD@v-=ZDt haDh C haDh`C5 ^Dt" hC5 ^Da"lD *xPAx4|jjlDh)PjhChiC(PjhChiCh \DjhCjœ%RjhCjh@[DjhCjhp[DjhCjhYDjhCjhCĈ=YD~V lDfDyؙ=YD%lD%R%R%5YDhC5 ^D\!lD *xPBx,{C@D@D@D @DC@Djh@Dh@DjhVCh @Dh @Djh`Ch@Dh@DjhiCh@Dh@DjhrCh@Dh@DjhzCjhcDjhChChCVp~scD cDt hCn~cDt hCX~cDt h CB~lD *xPBxzh`CxP}~yd[^_]NEW file%s %s %s=Y?>A@?U0WVSDžhChChcD覀XDhWDhCP}lD(P]S1  j.S tuV,S hCS1 VShCS  VLShCSVShCS VlShCSaD׹u SR{lD *<tthC5XDy jlPhaDjjhCLPhbDjjhCPhdDjjhCPhcDjjhC,PhhDjjhCjlD%jjhCj%jjhCj%jjhCj5`fDjjhCj5gDjjhCj 5bDjjhChChC5XDlD *<tthC5XDF Cٕٝ Cٝ=hDu1=hDu eDeDjPhgDjjhCPh`DjjhCPhpYDjjhCjRjjhCjlD%jjhCj5[DjjhCj%jjhCj5pcDjjhChCcĨhC5XDIlD *<tthC5XD jj5PWDjjhCj5FDjjh!Cj5_Djjh%CjlD%jjhCj%jjhCj5aDjjhCj5VDjjhCj5fDjjhCh)CwĨhC5XD]lD *<tthC5XD# hiClDh)PSHsjSlDh)PjjhChiC(PjjhChiCh \DjjhCj%jjhCj5@[DjjhCj5p[DjjhCj5YDjjhChCyĠhC5XD_lD *<tthC5XD% =cDCٕٝCٝCٝCٝjPh@DjjhVCPh @Djjh`CPh@DjjhiCPh@DjjhrCPh@DjjhzCjPjjhChC\lD *<tthC5XD[^_] $Id: xnd_rcry.c,v 1.2 2002/01/10 15:24:43 berar Exp $ GammaBetaAlphaCBACentr.phithetacoefPHITETAWgTWlTWg_CWl_CATA0PSITETZ_BlY_BlX_BlLengthAngled_c*d_b*d_a*wlitds_rdtds_spw_unc %s %6st&unknown atom %s in bond lengths or angles!t&UĀWVS]ShC5kDShC5 ^D1eD;})u&SVutrG@eD;|EeD‹M;}x&1ЋPML;4}AEE SuuHFG@eDLU;4|EeDM;|EPhC]SSj 1t[^_]dist%d %f %d liaisons, sigma = %.3f LENGHTANGLEcoord #%2d -> %[^; ]%*[; ]UWVS} u1G&eDkDhCju quHDDž@ vjoHfBЃPRhC5kDH@d$$0h$C5 ^D(jjjjhhFD}ICuBCPjjjڈHB$hOCj2tHB Dž< <;v' 0 : prefered orientation function is common to all experiment! n_orien < 0 : prefered orientation function depend of the experiment! %d * %d functions have to be read n_prof < 0 : profile function depend on the lines set! tds_000 tds_hkl compton uncoherent code implies : %s%s%s CELL %d != %d key(s) @SET_x are requested for multisets phases or rules evaluationR_BODYbloct& The rigid body klock #%d_ is made with %d atoms BLOC videt& The unit cell contains %d sites magnetic atoms are skipped: phase is not known as magnetic! modulated atoms are skipped: phase is not known as modulated! Big cell approximation of composite structure : %dc and %dc (%d*%.2f) LINES There is ZERO atom in the cell, assuming Fhkl = 1 for all lines of SET_%d DIFFUSE Usage contrainte invalidebond%d%d %d distance(s) %d angle(s) %f%3d T_bond %f &?&UVSh#5CR jDf<5CfL>5CNjjeDPjh?5CjPjhD5CjPjhJ5CjPjhO5CjPjh CjPjh@%Cj´RjhU5CLSSjh'CjhZ5C趧ĐuRShC5kDeDRRRRRPhb5C5kD,eDLPh5C5 ^DUeD$th 6C5 ^D. LP3v¡eD~=gD~h 6C5 ^DeDy+=gD~"5gDPh6C5 ^DeDxeDgDeDy 1҉eDth7C5 ^D6eDtY'Ct97CPeD'CtB7CPeD'CtK7CPh`7C5 ^DeDǀ5 ^DjjjjhFDh7CjjjieD (t u¡eDXeDwn¡eD\eDtr@PjZeD`@h7C@;PSeD~3XDHXD t&ujjTY¡eD` ? u5 ^D~ _DlDǀ%ǀ%ǀ%eDlDjEeD XjjjjhPFDh7CjjkP8h¡eDH$h7CjT¡eDLh7CjS¡eDPh7CjS¡eDT1$;v'eDLPh= C5kD]eDL4Vh8C5 ^D.h28CeDL<PQeDL$jL4$DeDP F;S9 _DueDǀlD%h@8C5 ^DeD Xu!lD%th8C5 ^D^eD\u!lD%th8C5 ^D/eD\ jDx,x 09GjG jD@,:CٽHHƅI ٭HH۝D٭HDd$$p,Vp,h9C5 ^D1ۃ$eD;}X'kD jD;X }pp, jDp(p$V CeD;|1ۡeD`lDvlD8t'jjjjjhI9Cjj0,e¡lDP$$eDu(lDx$t @$x uSh`9C5 ^D lD(CteD;|t-jjjjhFDh9Cjjjd¡eD4$h9C1ҡeDuu tRNeDjJf¡eDf h9Cj-P¡eD<ӍRPh9C5kD eDh9C5 ^D18Sh9C5kDd$$Vh9C5 ^Da FeD;|eDj¡eD@j¡eDDI8[^] $Id: xnd_rex1.c,v 1.2 2002/01/10 15:24:44 berar Exp $ step_fich(xnd_rex1.c)E_ZEROP No data point in file '%s'%d %f %fBloc #%d / %d non trouve%f%f%f%f%f%f' bloc #%d : dt0 %.3f ddt %.3f dtf %.3f sm %.0f dt0 %.3f dtf %.3f parametre en lecture bloc #%d /%dE_NEGAT Data File not increasing : %.4f >= %.4f%fi_obsE_READ Reading '%s' at %.4fdtheta%*[^ ]%*[ ]t&}:m4CUWVSDžLhDCFE HPvPVD Ph@DCujdEP PSK }#tʍ|PxPtPhdDCEPCtt ٝxٝ|مxECEuٝxم|ECEuٝ|ECٝD1;tE]$&tVhmDCPJujdSƒ tω߹HvpPlPhPdP`P\PhDCEP= wM$pGCGCGCGCGCGCGCECٝ`ٝhم\ٝlمdٝpt~bمpd$$مld$$مhd$$مdd$$م`d$$م\d$$VhDC5 ^DLCSYF9|hqECP@1;u}&h>LCSF;u|hqECP}t:1;u}t&h>LCSF;u|hqECPE@ t&uhSv PPPPS1}t مd$$مxd$$h@ECم؝xÈ@PBمLC3d$$Vh`LC1مLCtEu غR^Bمٕx]مUPVDR EuZ ؃}t&مEu()&EEuu ؍&]||u PVDEX`VDE؈]EPG*EEuPVDREuZ؋E@ ءPVDمxX Ph@DC|P@A=|d[^_]get_real_data(xnd_rex1.c)TEMPSIZEFILEDATA%f%d %[^ ] DIAG : T = %.3f, pts %4d : '%s' data filerUnknown file type %d data values get between %.3f and %.3f Warning, the number of values found is not the expected one Verif data_fichvmt&{Gz?U0WVShXPC-;E#PVDQCX@ j`VDPPVDRjhrPCjEPjhwPC RRjh|PCjhPC茐&E.&E &E &E lD%%u%u lDE+%imEEU+%k‰UE+%P$XE+%k %ldtst_alloc(xnd_use.c)E_ALLOC Allocating memories %u * %u : %s Memoire restante disponible pour %u elements de dimension %u Aucune memoire disponible t&UPWVSu}E =a~#haWu VhGC]SSj脔 h_CwWqt} tu VϡÃt&1ۅWu VhCEP_}t&kyu V|Ãtu VhC5 ^DWjhC5 ^DǟWjÓt72؍e[^_]str_alloc(xnd_use.c)str_alloc&UWS]1h:Clt߹P軟ǃhOCPSWe[_]E_FOPEN Failed in opening file '%s' : '%s' UpVS]u S耟ƃuuShC]SSj 蹒e[^] $Id: xnd_sets.c,v 1.2 2002/01/10 15:24:45 berar Exp $ sets_analyse (xnd_sets.c) added rules : ALLOW='%s' DENY='%s' NONE &'US]u1hxChC5 ^D { t;C 8t3PhC5 ^D辝C @UD0UDP C C{t9C8t1PhC5 ^DvC@UD0UDP CC{u{uhC5 ^D3hC5 ^D FD]]sets_extinction (xnd_sets.c)US]h͖C{tst{tst&1]]sets_make (xnd_sets.c)error realloc setsets UWVS]u hCCGt$k(PS誜hZCPhlCj(VOà ]19}$} MEB(E9|X؍e[^_]sets_fget (xnd_sets.c)SET_%dAUTOLOOPALLOWDENYLINESUPWVS]hCwju S ËE1;u }v'Vh+CWhjfCjjCPjh2Ch7CPjh8Ch7C|Pjh=Ch7CF(;u Re[^_]ÍvUVSuH"$Ct&$C@CpCCCCC CCQCpCCCC@CCCv&1vvv cÃ1vFuv 7e[t&vv 97vv 9vv 9vv 9vv 9vxvgv ]vHv >)pv2v (Yvvv ‰؉љ7vv ؙvVҡjDj^؍e[^]Ðsyntax error in '%s' : %s '%s' Uu u5@UDh CFD0UD1]unbalanced parenthesis int&'UVSU11ۃ=0UDuC!&<(t <)t t&AIuCB:ut VhkCb>(u~1 Be[^]%dunkown primitive unexpected char &UVSu ]=0UDt C; t;HuF,K<wJFg&EPhCS u9EFHqDDt-CDuvShCU vC; t;t ShC:e[^]empty right operand ofvUWVSu]=0UDt vt&C; tVS9u\1uVЍ\߹uVhC(EU SU Bt&1e[^_]empty left operand ofunbalanced parenthesis&UWVSu]C1=0UD:uwVS99vurЍ\}tf߹tfEU uU BSU B O<(t<)tGOC;ht.uhCq!Vh̟CdVhCUv1e[^_]|||&&&>=<=!====><!+-*/%unresolved sentence &UWVS]j߹PےESP'&'G?tWu? thCjVWJhCjVW1hCjVWhCjVWfhCjVWMh Cj VW4h CjVWhCjVWhCjVWhCjVWihCjVWPhCjVWghCj VWhCj VWuphCj VWu[h Cj VWuFh"CjVWu1hCjVWuVWuWh$Cuje[^_] $Id: xnd_vio.c,v 1.4 2003/07/16 15:05:55 berar Exp $ var_init_loopt&'UEU FDUD`UD}uhףCj5_DPUD]ÐU5PUD規]Í&'UEU ttP0' boundaries set (%d) for %s '|shift| < %f' hkln_atom=var_orderhkl=0%3d HKLH[%d] not found %3dHKL is node (0,0,0...) hkl lus max_orderE_READ Reading '%s' at %.4f%f %d_%8.3f %8s %2d_%5s %2d_%2d %12.6gcodeword to high (%3d %9.6f) ( ) %8s %12s %8s'U0WVSu_DEhChCjHjEǸjkUBM EBr[=YD>ot&1ۃ>t_B=vSBwB=YDlD;%t4>~1Q)ȃ=YDlD;%u~_Dtf> ~ahצC>PzuhC5kDӅ lD< u _D@ _D lD> lvuhC5kD Mt _D@ _DUMd$$E0hC5 ^D.hC5 ^DlDЅyB)‰Ѓu+@lDH9lDthChChC5 ^DӃlD@lDEE;@lD=@lDu`lDЅyB)‰Ѓu&PlDH9`lDthChC5 ^Dg `lD@`lDE;PlD==@lDu=PlDuEu=PlD =@lDth)C5 ^DEU9U!=PlDuEth)C5 ^Dނh)C5 ^D˂5 ^D踂_D+E܋MA1Ee[^_] %d -%d %d %3d %s %8.3f %s %s %15.8g %8f vU WVS}]UBPE8AP[E uUB~ =`lDu6h]C5XD~ v&Ed$$hqC5XD~t&hvC5XD~lD@lDE;@lD_=PlD~9`lDVUUUщ)k)ƒuhC5XD\~`lD@`lD;PlD=PlD~9`lDVUUUщ)k)ƒth)C5XD~EEU;ph)C5XD}e[^_]var_checkUWVSE}tE8txu 1Ht&h Cu1t&`lD=PlD']1lD;5@lD}?&WÃtLaDLE]ޡlD@lD;@lD|ȅt|EPu]}t^E `UDPUD ElD=@lD~3WÃtaDEL\lD@lD;@lD|`UD`lD@`lD;PlDGE;8Ee[^_]fput_var *%s %8s%d_%7.3f %*d (%d) * NOT GT0 ABS error, sigma2(%.2g)<0%3d %8s %2d %f %f t&'U@WVSE}E8 xhCUBttMI@Mt&E@@EԋUzJDMR1E;0t&`lD=PlDz'U]EEElDE;@lDv'VJÃt}aDDCÉVDDE] PhDE]ـE@uE@uE؃}tE]lD@lD;@lD]}m}tEE@L=UD1}uuh]C5 ^Dy E}CuUBFEhQC+M ;~E +E F EFEE F EFE~(u SOpF(SjP+p8Pv(4p‰V(} tEPjMPo ~,u$SoF,SjPo<Pv,o‰V,} tEPjMPo ~0u$]SoF0SjPpo<&EPv0uo‰V0} tEPjMP2o ~4u]S5oF4SjPo5EPv4o‰V4} tEPjMPn ~8u]SnF8Sjv(n5EPv8n‰V8} tEPjMPn 6v blocking parameter(s)t&'Null diagnonal element(s) ==> blocking parameter(s) #%d%s %d parameters are fixed %d parameters are fixed too much fixed parameters in the matrix ratio %f zero %d previous %d n_par %d too much fixed parameters in the matrix in divergent system RVECT[%d] %10.3g MAT-1 Matrix diagnonal element is zero, parameter #%d inverting matrix vq8 AUWVSEh7CF=VD;5 _DcDaDDd$$FPhSC5 ^Dj1ۃ9}Nd$$Sgfffؙ)k9øiCugCPhjC5 ^DjC9|hgC5 ^DjDhCEE}u)hC5 ^DNj=\Dt hChjgfffmE)kU)‰ЃiCugCPVhC5 ^Di=\Dt=gfffmE)kU)‰ЃiCugCPVhCi aD\\bDEu؍Jnu5fBjf;BltxttfBlf;Bntj1tcfBnf;BjtYu)PvjDfBjf;Blt=fBlf;Bnt3fBnf;Bjt)jDfXjfplfpjfXljнjDfXjfple[^_]É'U]É'UjDPl@n‰)‰Љ]Ít&'UjDPn@j‰)‰Љ]Ít&'UjDPj@l‰)‰Љ]Ít&'UjDPjHl@n‰)‰Љ]Ðt&UjDPjyډ)jDPlyډ)‰9uDjDPlyډ)jDPnyډ)‰9u1]UjDPlHj)@n‰UVUUUE)‰kU)‰Љ]ÐUjDPjHl)@n‰UVUUUE)‰kU)‰Љ]ÐUjDPj@l)‰UVUUUE)‰kU)‰Љ]Í&U1]Í&UEtBvIu MBwkFu ȉ]É' Unexpected case in ini_extinction xnd_sym.c)UE,A$1CCCCCCCCCCCCCCCCCCCCv`CNCGC>C7 C.C'C0CpChCj譲1]Í&UE,A$CCCQCCCCC`CCCCCCCwCCXCgCCpCCM`CF0C>C7C.C'CpCCPCC]Í&UE,Cwz$CvC@C@C@C@C'C@C@C@C@C@C@C@C@C C0C@C7CC&CCCCPC] $Id: xnd_keys.c,v 1.4 2003/07/16 15:05:55 berar Exp $ get_keys(xnd_key.c)unexpected type1 in get_keys(xnd_key.c), please report! %[@] no key %s unexpected key %s != %s Query mode for key '%s' : token '%s' = %d not token '%s' = %f %s initialised token '%s' = '%s' %s initialised %s%-10s key @ %s%-10s=; %d %s = %d ;%f %s = %f ; %s %s = '%s' ;' t&unexpected type2 in get_keys(xnd_key.c), please report!& key_word '%s' with value '%s' not recognised in key @%s vU WVSDžDžhCuEx&ZBt*t d^:BQBt=1ptV#Q hCjQDzG販ƅ5kDQǍPhC5kDQ@ƅt&5kDhSPhCSPƃ>?uFuVPtYu=} uuhC艭%t&u VSPtuVhCb jW5kDO*uh)C2EPt&XPt= tiv0hFC豬 yx]CuYCPd$$h`Co7z]CuYCPhC6@~hChChC5 ^DM"uhChC5 ^DMDžhCj1 >t> tt&@8t8 uUBZBV'N#t_ t $t& hCjMhCVM2hChCjxMhCVmMd$$hC5 ^DLDž(hCj"MhCVMh C5 ^D;LDž$<h]CjLƃ> u &F> t>'uJFhCVLVLh]CjLƃF>;t> t> t> t뉵}hCVdLƃtЍD 1H9tt8 t8 t8 t8 tt@VLDžh C5 ^DK,t t h Cj>Rt Qu(hCjiKuPVh`C覨DžhC=Kƃt4>t/Dž> uF> t> t > hC5 ^D8JƅkD@ uCPKǃkDHxyPKkD@@t@t5kDPK72[^_]new_keys(xnd_key.c) @%s ; %s%s = %d%s%s = %f%s%s = %s%s%s = '%s'unexpected type in new_keys(xnd_keys.c), please report!&UWVShACu=FDu DžpDžt]suhUC5XDH]C| |l'tt2puuhUClH \C|CSxtc tvC;Cux;FDtpPVlh`CSCE@ux;FDjtpd$$VlhjCt&{C+#WP Hux;FDtpWVlhtC5XDF{CWPGux;FDtj'WGuGuWVlh~C5XDxFH(v DžpHp@DžpuWVlhtC5XD'FhCj:shC5XDEnitT[^_] $Id: xnd_atom.c,v 1.2 2002/01/10 15:24:44 berar Exp $ &UVSukDxtMpV(FkDx t(H HqDDt ADuQV"F>0kDp VEe[^]sqrtvU@Sd$EU$C]ȃEPEPy}EEufEECEU]tC]=CtEPu kE!Et YE‹EEEȋ]]acost&'U@Sd$EU$KC]ȃEPEPu~EPEPɃEuaEЃEECEU]]tEP$u D!Et ~D‹EE Eȋ]]U EUE%=!?%jjjd$$G&'=~ EPd$$t t5t]t?VjEPEPEPEPN&EPEPEPEP0jEPEPEPEPEPEPEPEP]log10U@Sd$EU$C]ȃEPEP EـÈ@EܐCEU]uC D]EE@u!=CEu!B"/t&=CEtEP u wB!Et eB‹EEEȋ]]u<7~u<7~U WVSEU]MډȉE%y\CE xE1&'U% ЅEEщ}u!u CEy UEE!qt&3~ usoEmEEtWCEu1y$uC4)ѸM;EsCEUM!Mߋu}uE萍t&[^_]9B.@Q0-Iexpt&9B.@GQ0-IU@Sd$E$}mɃCUЃ؍d$$}măXCEu9EEPCEU]u`C D]=C5hCEuZEɃEPCEU]]tEP< u ?"Et ?‹EE Eً]]U EUE%=!?jjd$$=~ EPd$$ t,t]t:VEPEPEPEP/PjEPEPEPEP5EPEPEPEPt&jEPEPEPEP]U EUE%=!?jjjd$$H=~ RO~ı!>88ı!>RO~>wQlVLUUUUU???&U VSEEUU?>,}uE muUmEut&ȁ23? DD DDD$D ,DL?~4D1ɉM]E荴& ,D[^]DNn)W'4b<ACcQޫa:n$MBI .)>5D.&pA~_֑9S99_(;/ Zmm~6 'FOf?-_'u={9Rk_]0V{Fk 6^ae_@h'sM1Vɨs{`k!?! @|@!@zj@|"@%@!)@:F,@zj/@\G1@|2@k4@5@ۏ7@!9@:@:F<@Z=@zj?@L~@@\GA@lB@|B@C@kD@4E@E@F@ۏG@XH@!I@?pAm0_?@T!?1cba=`a=sp.;.;I %{9@T!?1cba=`a=sp.;m0_??.;I %{9pAU`WVSEuUЋEԉE܉Á!?1^{@ك}~?!?%,Dt4D%<DDD^!?,Dt4D&<DDD^O!9AAٍd$$ LDTD}EE mE]mMQ$Y ,D 4D;XDt ]ȋE%)ƒz <D DD]E%)Ã1~; \D dDɐt&VE܅ى^~1V]]MMEE)ʉUElD1ҍ]ɍ'}ME mMUmEP$X\BɃ~ٺ]E@ut&JfE@thTDjRWEVP.E܅yىF^ ؐt&ȍe[^_]?IUUUUUſ?a*}W>+Z|Z:=|Z:=+Z}W>a*?IUUUUUſ?UEEUE%=?>0}UE mUUmE ȋE D D D D Du D-& D  Dى]PC&{?`PD?6+Y=PC6+Y=&{?`PD?U0SEU؋M؋]܉ȉډщ1ہK% Ѕu$ Dy , DUM ~tt&ڸ)ЍR$Z] MEd$$}m < D 4 D D Dv']̉]UE ]%-??࿜u<7~p9B.@Q0-IB.?B.vUUUUU?lf,%jV?kAФri7f>9B.@Q0-I+eG?u<7~Фri7f>kA,%jV?lf>UUUUU?@p&U@SEUUA.@vyv2UE …t t&DEuDDEuvvB.?vxف?wܠD))݀DDtD D}EE mE]m]S$[ D D>t&/>w DEu1ȅ D$D,D4D<Du%DD_Ɂ-DD| UE]]E,'UЋE]>]E LDً]]?-DT!?\3&-DT!?\3&<&U0VS]EEUMʁ/>]}uE muUmEu@UE C …ud$$}Dp'?~&y D-DD'? 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d5Dlibgcc2.c/build2/gcc//src/gcc/libgcc2.cint:t(0,1)=r(0,1);0020000000000;0017777777777;char:t(0,2)=r(0,2);0;127;long int:t(0,3)=r(0,1);0020000000000;0017777777777;unsigned int:t(0,4)=r(0,1);0000000000000;0037777777777;long unsigned int:t(0,5)=r(0,1);0000000000000;0037777777777;long long int:t(0,6)=r(0,1);01000000000000000000000;0777777777777777777777;long long unsigned int:t(0,7)=r(0,1);0000000000000;01777777777777777777777;short int:t(0,8)=r(0,8);-32768;32767;short unsigned int:t(0,9)=r(0,9);0;65535;signed char:t(0,10)=r(0,10);-128;127;unsigned char:t(0,11)=r(0,11);0;255;float:t(0,12)=r(0,1);4;0;double:t(0,13)=r(0,1);8;0;long double:t(0,14)=r(0,1);12;0;complex int:t(0,15)=s8real:(0,1),0,32;imag:(0,1),32,32;;complex float:t(0,16)=r(0,16);4;0;complex double:t(0,17)=r(0,17);8;0;complex long double:t(0,18)=r(0,18);12;0;void:t(0,19)=(0,19)tconfig.h/src/gcc/gansidecl.h/src/gcc/../include/ansidecl.h/src/gcc/config/i386/xm-i386.htm.h/src/gcc/config/i386/cygwin.h/src/gcc/config/i386/gas.h/src/gcc/config/i386/i386.hprocessor_costs:T(8,1)=s32add:(0,1),0,32;lea:(0,1),32,32;shift_var:(0,1),64,32;shift_const:(0,1),96,32;mult_init:(0,1),128,32;mult_bit:(0,1),160,32;divide:(0,1),192,32;large_insn:(0,1),224,32;;processor_type:T(8,2)=ePROCESSOR_I386:0,PROCESSOR_I486:1,PROCESSOR_PENTIUM:2,PROCESSOR_PENTIUMPRO:3,PROCESSOR_K6:4,PROCESSOR_max:5,;reg_class:T(8,3)=eNO_REGS:0,AREG:1,DREG:2,CREG:3,BREG:4,SIREG:5,DIREG:6,AD_REGS:7,Q_REGS:8,NON_Q_REGS:9,INDEX_REGS:10,GENERAL_REGS:11,FP_TOP_REG:12,FP_SECOND_REG:13,FLOAT_REGS:14,ALL_REGS:15,LIM_REG_CLASSES:16,;ix86_args:T(8,4)=s12words:(0,1),0,32;nregs:(0,1),32,32;regno:(0,1),64,32;;CUMULATIVE_ARGS:t(8,5)=(8,4)/src/gcc/config/i386/bsd.h/src/gcc/config/i386/unix.h/src/gcc/config/dbxcoff.h/src/gcc/config/i386/xm-cygwin.h/src/gcc/machmode.h/src/gcc/machmode.defmachine_mode:T(13,1)=eVOIDmode:0,PQImode:1,QImode:2,PHImode:3,HImode:4,PSImode:5,SImode:6,PDImode:7,DImode:8,TImode:9,OImode:10,QFmode:11,HFmode:12,TQFmode:13,SFmode:14,DFmode:15,XFmode:16,TFmode:17,QCmode:18,HCmode:19,SCmode:20,DCmode:21,XCmode:22,TCmode:23,CQImode:24,CHImode:25,CSImode:26,CDImode:27,CTImode:28,COImode:29,BLKmode:30,CCmode:31,CCNOmode:32,CCFPmode:33,CCFPUmode:34,MAX_MACHINE_MODE:35,;mode_class:T(13,2)=eMODE_RANDOM:0,MODE_INT:1,MODE_FLOAT:2,MODE_PARTIAL_INT:3,MODE_CC:4,MODE_COMPLEX_INT:5,MODE_COMPLEX_FLOAT:6,MAX_MODE_CLASS:7,;/src/gcc/defaults.hinclude/stddef.hptrdiff_t:t(16,1)=(0,1)size_t:t(16,2)=(0,4)wchar_t:t(16,3)=(0,9)wint_t:t(16,4)=(0,4)UQItype:t(0,20)=(0,11)SItype:t(0,21)=(0,1)USItype:t(0,22)=(0,4)DItype:t(0,23)=(0,6)UDItype:t(0,24)=(0,7)SFtype:t(0,25)=(0,12)DFtype:t(0,26)=(0,13)XFtype:t(0,27)=(0,14)word_type:t(0,28)=(0,1)DIstruct:T(0,29)=s8low:(0,21),0,32;high:(0,21),32,32;;DIunion:t(0,30)=(0,31)=u8s:(0,29),0,64;ll:(0,23),0,64;;/src/gcc/gbl-ctors.hfunc_ptr:t(17,1)=(17,2)=*(17,3)=f(0,19)__CTOR_LIST__:G(0,32)=ar(0,1);0;1;(17,1)__DTOR_LIST__:G(0,32).file 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