No title
1
13.835340 0.000000 0.000000
0.000000 13.835340 0.000000
0.000000 0.000000 24.767960
Ti O Si C H Cl
72 145 1 3 10 1
Direct configuration= 1
0.00483810 0.16532034 0.58999116
0.17083330 0.33244224 0.27221722
0.00637112 0.16328833 0.45945020
0.17083330 0.33244224 0.39099931
0.00416663 0.16577557 0.33160827
0.17367533 0.33124610 0.50675414
0.00416663 0.16577557 0.21282618
0.17300824 0.33223796 0.62254069
0.00773450 0.49528548 0.58788669
0.17083330 0.66577557 0.27221722
0.00579848 0.49786756 0.45901216
0.17083330 0.66577557 0.39099931
0.00416663 0.49910891 0.33160827
0.17372722 0.66279043 0.50683404
0.00416663 0.49910891 0.21282618
0.17090222 0.66551463 0.62263920
0.00359962 0.83168014 0.58964740
0.17083330 0.99910891 0.27221722
0.00609421 0.82934388 0.45969459
0.17083330 0.99910891 0.39099931
0.00416663 0.83244224 0.33160827
0.17203199 0.99727167 0.50655537
0.00416663 0.83244224 0.21282618
0.17071106 0.99868538 0.62266444
0.33753476 0.16541806 0.58912369
0.50416663 0.33244224 0.27221722
0.33871408 0.16479589 0.45904728
0.50416663 0.33244224 0.39099931
0.33749996 0.16577557 0.33160827
0.50698976 0.32984346 0.50679236
0.33749996 0.16577557 0.21282618
0.50502408 0.33216280 0.62260529
0.34129904 0.50218367 0.59028288
0.50416663 0.66577557 0.27221722
0.34150198 0.49755092 0.45989384
0.50416663 0.66577557 0.39099931
0.33749996 0.49910891 0.33160827
0.50577583 0.66242402 0.51078327
0.33749996 0.49910891 0.21282618
0.50538731 0.66746092 0.63233245
0.33390008 0.83523361 0.58631533
0.50416663 0.99910891 0.27221722
0.34017568 0.82953394 0.45884314
0.50416663 0.99910891 0.39099931
0.33749996 0.83244224 0.33160827
0.50490633 0.99857274 0.50669230
0.33749996 0.83244224 0.21282618
0.50324618 0.99943507 0.62266394
0.67144940 0.16525808 0.58927781
0.83749996 0.33244224 0.27221722
0.67366322 0.16298465 0.45951223
0.83749996 0.33244224 0.39099931
0.67083330 0.16577557 0.33160827
0.84066121 0.32936970 0.50661155
0.67083330 0.16577557 0.21282618
0.83818590 0.33169474 0.62274357
0.67510340 0.49629416 0.58681437
0.83749996 0.66577557 0.27221722
0.67314831 0.49758215 0.45893771
0.83749996 0.66577557 0.39099931
0.67083330 0.49910891 0.33160827
0.83967427 0.66376838 0.50812255
0.67083330 0.49910891 0.21282618
0.84106833 0.66201363 0.62578548
0.66451275 0.83348981 0.58692655
0.83749996 0.99910891 0.27221722
0.67208381 0.82770188 0.45906707
0.83749996 0.99910891 0.39099931
0.67083330 0.83244224 0.33160827
0.83934867 0.99540039 0.50676556
0.67083330 0.83244224 0.21282618
0.83735165 0.99831040 0.62254364
0.10500497 0.26461540 0.57387417
0.26486663 0.23840891 0.27221722
0.07679996 0.09314224 0.27221722
0.23830682 0.06584453 0.57337085
0.10565034 0.26600262 0.45355131
0.26486663 0.23840891 0.39099931
0.07679996 0.09314224 0.39099931
0.23687198 0.06512490 0.45323518
0.09819996 0.25980891 0.33160827
0.27275202 0.23099416 0.51413827
0.07075306 0.09921935 0.51398905
0.24346663 0.07174224 0.33160827
0.09819996 0.25980891 0.21282618
0.26712746 0.23572686 0.63817303
0.07575684 0.09444328 0.63869146
0.24346663 0.07174224 0.21282618
0.10526300 0.59724886 0.57333530
0.26486663 0.57174224 0.27221722
0.07679996 0.42647557 0.27221722
0.23917211 0.39902895 0.57351911
0.10533968 0.59893693 0.45312347
0.26486663 0.57174224 0.39099931
0.07679996 0.42647557 0.39099931
0.23766512 0.39817398 0.45332750
0.09819996 0.59314224 0.33160827
0.27300200 0.56442312 0.51424785
0.07093231 0.43270252 0.51392200
0.24346663 0.40507557 0.33160827
0.09819996 0.59314224 0.21282618
0.26542242 0.57076728 0.63871655
0.07719073 0.42575935 0.63824435
0.24346663 0.40507557 0.21282618
0.10390873 0.93161228 0.57326940
0.26486663 0.90507557 0.27221722
0.07679996 0.75980891 0.27221722
0.23495457 0.73302883 0.57252602
0.10477342 0.93285061 0.45322577
0.26486663 0.90507557 0.39099931
0.07679996 0.75980891 0.39099931
0.23726295 0.73117002 0.45323521
0.09819996 0.92647557 0.33160827
0.27179960 0.89799640 0.51277088
0.07003543 0.76505238 0.51371611
0.24346663 0.73840891 0.33160827
0.09819996 0.92647557 0.21282618
0.26396884 0.90559421 0.63848625
0.07585660 0.76054660 0.63819836
0.24346663 0.73840891 0.21282618
0.43750565 0.26426188 0.57376993
0.59819996 0.23840891 0.27221722
0.41013330 0.09314224 0.27221722
0.57132166 0.06615961 0.57370261
0.43831367 0.26591206 0.45316686
0.59819996 0.23840891 0.39099931
0.41013330 0.09314224 0.39099931
0.57088072 0.06440112 0.45322660
0.43153330 0.25980891 0.33160827
0.60570618 0.23009011 0.51371309
0.40408711 0.09980401 0.51356129
0.57679996 0.07174224 0.33160827
0.43153330 0.25980891 0.21282618
0.59994699 0.23585208 0.63804583
0.40877614 0.09435039 0.63829817
0.57679996 0.07174224 0.21282618
0.43726034 0.59770445 0.57726301
0.59819996 0.57174224 0.27221722
0.41013330 0.42647557 0.27221722
0.57269732 0.39559854 0.57258186
0.43936680 0.59977650 0.45476570
0.59819996 0.57174224 0.39099931
0.41013330 0.42647557 0.39099931
0.57071812 0.39788780 0.45331932
0.43153330 0.59314224 0.33160827
0.60633873 0.56389834 0.51403122
0.40485820 0.43259120 0.51417114
0.57679996 0.40507557 0.33160827
0.43153330 0.59314224 0.21282618
0.60330250 0.56461448 0.63119022
0.40974051 0.42566962 0.63859140
0.57679996 0.40507557 0.21282618
0.43650399 0.93452938 0.57275959
0.59819996 0.90507557 0.27221722
0.41013330 0.75980891 0.27221722
0.57198949 0.73315865 0.57703237
0.43882719 0.93273109 0.45335979
0.59819996 0.90507557 0.39099931
0.41013330 0.75980891 0.39099931
0.56997934 0.73067956 0.45496694
0.43153330 0.92647557 0.33160827
0.60570668 0.89713740 0.51463771
0.40356039 0.76619339 0.51377253
0.57679996 0.73840891 0.33160827
0.43153330 0.92647557 0.21282618
0.59918103 0.90520203 0.63773098
0.40319422 0.76395604 0.63105772
0.57679996 0.73840891 0.21282618
0.77119029 0.26414084 0.57336413
0.93153330 0.23840891 0.27221722
0.74346663 0.09314224 0.27221722
0.90530580 0.06575638 0.57392884
0.77244553 0.26537334 0.45319756
0.93153330 0.23840891 0.39099931
0.74346663 0.09314224 0.39099931
0.90405922 0.06433233 0.45349751
0.76486663 0.25980891 0.33160827
0.93939876 0.23056819 0.51395738
0.73728331 0.09887411 0.51407182
0.91013330 0.07174224 0.33160827
0.76486663 0.25980891 0.21282618
0.93393638 0.23583363 0.63859103
0.74250711 0.09388591 0.63808198
0.91013330 0.07174224 0.21282618
0.77430795 0.59770649 0.57441712
0.93153330 0.57174224 0.27221722
0.74346663 0.42647557 0.27221722
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0.93153330 0.57174224 0.39099931
0.74346663 0.42647557 0.39099931
0.90452725 0.39760262 0.45318077
0.76486663 0.59314224 0.33160827
0.93948963 0.56435575 0.51339460
0.73836118 0.43204637 0.51272847
0.91013330 0.40507557 0.33160827
0.76486663 0.59314224 0.21282618
0.93694886 0.56739408 0.63554688
0.74543223 0.42423875 0.63859475
0.91013330 0.40507557 0.21282618
0.77110323 0.93215592 0.57324708
0.93153330 0.90507557 0.27221722
0.74346663 0.75980891 0.27221722
0.90512219 0.73248302 0.57538541
0.77160899 0.93221068 0.45334562
0.93153330 0.90507557 0.39099931
0.74346663 0.75980891 0.39099931
0.90351547 0.73134926 0.45369541
0.76486663 0.92647557 0.33160827
0.93888250 0.89696089 0.51437433
0.73694169 0.76566323 0.51406642
0.91013330 0.73840891 0.33160827
0.76486663 0.92647557 0.21282618
0.93380814 0.90433119 0.63820539
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0.91013330 0.73840891 0.21282618
0.51191730 0.67288392 0.70574913
0.46289375 0.66428985 0.81534545
0.39878457 0.55181865 0.80040165
0.49842903 0.67027770 0.88121772
0.40230359 0.77474265 0.80007523
0.38107878 0.54776417 0.76076691
0.43771763 0.48715855 0.80880744
0.33708163 0.55050400 0.82225564
0.53831108 0.60830278 0.88936649
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0.44150520 0.67100550 0.90551015
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0.69408977 0.64539077 0.78740626