No title
1.0
13.83534000 0.00000000 0.00000000
0.00000000 13.83534000 0.00000000
0.00000000 0.00000000 24.76796000
Ti O Si C H Cl
72 145 1 3 10 1
Selective dynamics
Direct
0.00371103 0.16413443 0.59178657 T T T # 1 Ti1
0.16919270 0.33155114 0.27400962 F F F # 2 Ti2
0.00415744 0.16261968 0.46121610 T T T # 3 Ti3
0.16919270 0.33155114 0.39279171 F F F # 4 Ti4
0.00252603 0.16488447 0.33340067 F F F # 5 Ti5
0.17101525 0.33097900 0.50850458 T T T # 6 Ti6
0.00252603 0.16488447 0.21461858 F F F # 7 Ti7
0.17230562 0.33108687 0.62418922 T T T # 8 Ti8
0.00893327 0.49147118 0.58824751 T T T # 9 Ti9
0.16919270 0.66488447 0.27400962 F F F # 10 Ti10
0.00260720 0.49859685 0.46031842 T T T # 11 Ti11
0.16919270 0.66488447 0.39279171 F F F # 12 Ti12
0.00252603 0.49821781 0.33340067 F F F # 13 Ti13
0.17197682 0.66203849 0.50860944 T T T # 14 Ti14
0.00252603 0.49821781 0.21461858 F F F # 15 Ti15
0.16904860 0.66439772 0.62425238 T T T # 16 Ti16
0.00093449 0.83021864 0.59183673 T T T # 17 Ti17
0.16919270 0.99821781 0.27400962 F F F # 18 Ti18
0.00395282 0.82804600 0.46160591 T T T # 19 Ti19
0.16919270 0.99821781 0.39279171 F F F # 20 Ti20
0.00252603 0.83155114 0.33340067 F F F # 21 Ti21
0.16960795 0.99644295 0.50837015 T T T # 22 Ti22
0.00252603 0.83155114 0.21461858 F F F # 23 Ti23
0.16914414 0.99721665 0.62438291 T T T # 24 Ti24
0.33554413 0.16478412 0.59079557 T T T # 25 Ti25
0.50252603 0.33155114 0.27400962 F F F # 26 Ti26
0.33541649 0.16540202 0.46034726 T T T # 27 Ti27
0.50252603 0.33155114 0.39279171 F F F # 28 Ti28
0.33585936 0.16488447 0.33340067 F F F # 29 Ti29
0.50556365 0.32908938 0.50852968 T T T # 30 Ti30
0.33585936 0.16488447 0.21461858 F F F # 31 Ti31
0.50346055 0.33168765 0.62415934 T T T # 32 Ti32
0.34011455 0.50203427 0.59164508 T T T # 33 Ti33
0.50252603 0.66488447 0.27400962 F F F # 34 Ti34
0.33962668 0.49642518 0.46152693 T T T # 35 Ti35
0.50252603 0.66488447 0.39279171 F F F # 36 Ti36
0.33585936 0.49821781 0.33340067 F F F # 37 Ti37
0.50251090 0.66096158 0.51275055 T T T # 38 Ti38
0.33585936 0.49821781 0.21461858 F F F # 39 Ti39
0.50620452 0.66724548 0.63425548 T T T # 40 Ti40
0.33207803 0.83378249 0.58804274 T T T # 41 Ti41
0.50252603 0.99821781 0.27400962 F F F # 42 Ti42
0.33787547 0.82908044 0.46053585 T T T # 43 Ti43
0.50252603 0.99821781 0.39279171 F F F # 44 Ti44
0.33585936 0.83155114 0.33340067 F F F # 45 Ti45
0.50080876 0.00024259 0.50834524 T T T # 46 Ti46
0.33585936 0.83155114 0.21461858 F F F # 47 Ti47
0.50059427 0.99950101 0.62431590 T T T # 48 Ti48
0.66960846 0.16469472 0.59098936 T T T # 49 Ti49
0.83585936 0.33155114 0.27400962 F F F # 50 Ti50
0.67220875 0.16217632 0.46125260 T T T # 51 Ti51
0.83585936 0.33155114 0.39279171 F F F # 52 Ti52
0.66919270 0.16488447 0.33340067 F F F # 53 Ti53
0.83865073 0.32889693 0.50840918 T T T # 54 Ti54
0.66919270 0.16488447 0.21461858 F F F # 55 Ti55
0.83696983 0.33045753 0.62449052 T T T # 56 Ti56
0.67436711 0.49565025 0.58877227 T T T # 57 Ti57
0.83585936 0.66488447 0.27400962 F F F # 58 Ti58
0.67133602 0.49758639 0.46089149 T T T # 59 Ti59
0.83585936 0.66488447 0.39279171 F F F # 60 Ti60
0.66919270 0.49821781 0.33340067 F F F # 61 Ti61
0.83698068 0.66370574 0.51121759 T T T # 62 Ti62
0.66919270 0.49821781 0.21461858 F F F # 63 Ti63
0.84235813 0.65821050 0.63063064 T T T # 64 Ti64
0.65895669 0.83724318 0.58536359 T T T # 65 Ti65
0.83585936 0.99821781 0.27400962 F F F # 66 Ti66
0.66990844 0.82623743 0.45994932 T T T # 67 Ti67
0.83585936 0.99821781 0.39279171 F F F # 68 Ti68
0.66919270 0.83155114 0.33340067 F F F # 69 Ti69
0.83769547 0.99432816 0.50847124 T T T # 70 Ti70
0.66919270 0.83155114 0.21461858 F F F # 71 Ti71
0.83574173 0.99784669 0.62417739 T T T # 72 Ti72
0.10372278 0.26367289 0.57550880 T T T # 73 O1
0.26322603 0.23751781 0.27400962 F F F # 74 O2
0.07515936 0.09225114 0.27400962 F F F # 75 O3
0.23680289 0.06484653 0.57517469 T T T # 76 O4
0.10399794 0.26513688 0.45523995 T T T # 77 O5
0.26322603 0.23751781 0.39279171 F F F # 78 O6
0.07515936 0.09225114 0.39279171 F F F # 79 O7
0.23496227 0.06444145 0.45501652 T T T # 80 O8
0.09655936 0.25891781 0.33340067 F F F # 81 O9
0.27087203 0.23021764 0.51585012 T T T # 82 O10
0.06891923 0.09849968 0.51583780 T T T # 83 O11
0.24182603 0.07085114 0.33340067 F F F # 84 O12
0.09655936 0.25891781 0.21461858 F F F # 85 O13
0.26606146 0.23463057 0.64014421 T T T # 86 O14
0.07441543 0.09357866 0.64042831 T T T # 87 O15
0.24182603 0.07085114 0.21461858 F F F # 88 O16
0.10464707 0.59572585 0.57461314 T T T # 89 O17
0.26322603 0.57085114 0.27400962 F F F # 90 O18
0.07515936 0.42558447 0.27400962 F F F # 91 O19
0.23779048 0.39822451 0.57504588 T T T # 92 O20
0.10349776 0.59805840 0.45479211 T T T # 93 O21
0.26322603 0.57085114 0.39279171 F F F # 94 O22
0.07515936 0.42558447 0.39279171 F F F # 95 O23
0.23590376 0.39719171 0.45505706 T T T # 96 O24
0.09655936 0.59225114 0.33340067 F F F # 97 O25
0.27151917 0.56364224 0.51579315 T T T # 98 O26
0.06897053 0.43196559 0.51543104 T T T # 99 O27
0.24182603 0.40418447 0.33340067 F F F # 100 O28
0.09655936 0.59225114 0.21461858 F F F # 101 O29
0.26430377 0.57039702 0.64035589 T T T # 102 O30
0.07676169 0.42368690 0.64015648 T T T # 103 O31
0.24182603 0.40418447 0.21461858 F F F # 104 O32
0.10224765 0.93051199 0.57496613 T T T # 105 O33
0.26322603 0.90418447 0.27400962 F F F # 106 O34
0.07515936 0.75891781 0.27400962 F F F # 107 O35
0.23265231 0.73229409 0.57400994 T T T # 108 O36
0.10286726 0.93190386 0.45497195 T T T # 109 O37
0.26322603 0.90418447 0.39279171 F F F # 110 O38
0.07515936 0.75891781 0.39279171 F F F # 111 O39
0.23550329 0.73036629 0.45489635 T T T # 112 O40
0.09655936 0.92558447 0.33340067 F F F # 113 O41
0.26987285 0.89726200 0.51430265 T T T # 114 O42
0.06794746 0.76374229 0.51547769 T T T # 115 O43
0.24182603 0.73751781 0.33340067 F F F # 116 O44
0.09655936 0.92558447 0.21461858 F F F # 117 O45
0.26236016 0.90451245 0.64039651 T T T # 118 O46
0.07431843 0.75939821 0.63999661 T T T # 119 O47
0.24182603 0.73751781 0.21461858 F F F # 120 O48
0.43571051 0.26342195 0.57549758 T T T # 121 O49
0.59655936 0.23751781 0.27400962 F F F # 122 O50
0.40849270 0.09225114 0.27400962 F F F # 123 O51
0.56892650 0.06585334 0.57532328 T T T # 124 O52
0.43640983 0.26509949 0.45487508 T T T # 125 O53
0.59655936 0.23751781 0.39279171 F F F # 126 O54
0.40849270 0.09225114 0.39279171 F F F # 127 O55
0.56912310 0.06349140 0.45499739 T T T # 128 O56
0.42989270 0.25891781 0.33340067 F F F # 129 O57
0.60400234 0.22913787 0.51541783 T T T # 130 O58
0.40205791 0.09926776 0.51512246 T T T # 131 O59
0.57515936 0.07085114 0.33340067 F F F # 132 O60
0.42989270 0.25891781 0.21461858 F F F # 133 O61
0.59817707 0.23510736 0.63976527 T T T # 134 O62
0.40679831 0.09383631 0.64021421 T T T # 135 O63
0.57515936 0.07085114 0.21461858 F F F # 136 O64
0.43585132 0.59750332 0.57861045 T T T # 137 O65
0.59655936 0.57085114 0.27400962 F F F # 138 O66
0.40849270 0.42558447 0.27400962 F F F # 139 O67
0.57122818 0.39442310 0.57400277 T T T # 140 O68
0.43754326 0.59880354 0.45630828 T T T # 141 O69
0.59655936 0.57085114 0.39279171 F F F # 142 O70
0.40849270 0.42558447 0.39279171 F F F # 143 O71
0.56916538 0.39708056 0.45506607 T T T # 144 O72
0.42989270 0.59225114 0.33340067 F F F # 145 O73
0.60460975 0.56347880 0.51572196 T T T # 146 O74
0.40325476 0.43185005 0.51581111 T T T # 147 O75
0.57515936 0.40418447 0.33340067 F F F # 148 O76
0.42989270 0.59225114 0.21461858 F F F # 149 O77
0.59927487 0.56196069 0.63286400 T T T # 150 O78
0.40827386 0.42540098 0.63999695 T T T # 151 O79
0.57515936 0.40418447 0.21461858 F F F # 152 O80
0.43436394 0.93395407 0.57454036 T T T # 153 O81
0.59655936 0.90418447 0.27400962 F F F # 154 O82
0.40849270 0.75891781 0.27400962 F F F # 155 O83
0.56962577 0.73283061 0.57852034 T T T # 156 O84
0.43712938 0.93204020 0.45513445 T T T # 157 O85
0.59655936 0.90418447 0.39279171 F F F # 158 O86
0.40849270 0.75891781 0.39279171 F F F # 159 O87
0.56814313 0.73002558 0.45672870 T T T # 160 O88
0.42989270 0.92558447 0.33340067 F F F # 161 O89
0.60406494 0.89631643 0.51664583 T T T # 162 O90
0.40169491 0.76545051 0.51540345 T T T # 163 O91
0.57515936 0.73751781 0.33340067 F F F # 164 O92
0.42989270 0.92558447 0.21461858 F F F # 165 O93
0.59710523 0.90489379 0.63871753 T T T # 166 O94
0.40020569 0.76154770 0.63238221 T T T # 167 O95
0.57515936 0.73751781 0.21461858 F F F # 168 O96
0.76954796 0.26312524 0.57512412 T T T # 169 O97
0.92989270 0.23751781 0.27400962 F F F # 170 O98
0.74182603 0.09225114 0.27400962 F F F # 171 O99
0.90377067 0.06525196 0.57560793 T T T # 172 O100
0.77062043 0.26466204 0.45492388 T T T # 173 O101
0.92989270 0.23751781 0.39279171 F F F # 174 O102
0.74182603 0.09225114 0.39279171 F F F # 175 O103
0.90245160 0.06344509 0.45514131 T T T # 176 O104
0.76322603 0.25891781 0.33340067 F F F # 177 O105
0.93755840 0.22987226 0.51542796 T T T # 178 O106
0.73560482 0.09809514 0.51572220 T T T # 179 O107
0.90849270 0.07085114 0.33340067 F F F # 180 O108
0.76322603 0.25891781 0.21461858 F F F # 181 O109
0.93240324 0.23469714 0.64034728 T T T # 182 O110
0.74044223 0.09293899 0.63975973 T T T # 183 O111
0.90849270 0.07085114 0.21461858 F F F # 184 O112
0.77231159 0.59731398 0.57797929 T T T # 185 O113
0.92989270 0.57085114 0.27400962 F F F # 186 O114
0.74182603 0.42558447 0.27400962 F F F # 187 O115
0.90473600 0.39557809 0.57447363 T T T # 188 O116
0.77052377 0.59946915 0.45608938 T T T # 189 O117
0.92989270 0.57085114 0.39279171 F F F # 190 O118
0.74182603 0.42558447 0.39279171 F F F # 191 O119
0.90266100 0.39696925 0.45489475 T T T # 192 O120
0.76322603 0.59225114 0.33340067 F F F # 193 O121
0.93730137 0.56373218 0.51481114 T T T # 194 O122
0.73671960 0.43164612 0.51478510 T T T # 195 O123
0.90849270 0.40418447 0.33340067 F F F # 196 O124
0.76322603 0.59225114 0.21461858 F F F # 197 O125
0.93808049 0.56412814 0.63479785 T T T # 198 O126
0.74386901 0.42293391 0.64024927 T T T # 199 O127
0.90849270 0.40418447 0.21461858 F F F # 200 O128
0.76952505 0.93229759 0.57451067 T T T # 201 O129
0.92989270 0.90418447 0.27400962 F F F # 202 O130
0.74182603 0.75891781 0.27400962 F F F # 203 O131
0.90289663 0.73170355 0.57875529 T T T # 204 O132
0.76978841 0.93127609 0.45506502 T T T # 205 O133
0.92989270 0.90418447 0.39279171 F F F # 206 O134
0.74182603 0.75891781 0.39279171 F F F # 207 O135
0.90121296 0.73034621 0.45600605 T T T # 208 O136
0.76322603 0.92558447 0.33340067 F F F # 209 O137
0.93701115 0.89593962 0.51627107 T T T # 210 O138
0.73461724 0.76528394 0.51567714 T T T # 211 O139
0.90849270 0.73751781 0.33340067 F F F # 212 O140
0.76322603 0.92558447 0.21461858 F F F # 213 O141
0.93208593 0.90432318 0.64016442 T T T # 214 O142
0.73962870 0.76529126 0.63782517 T T T # 215 O143
0.90849270 0.73751781 0.21461858 F F F # 216 O144
0.51963158 0.68347826 0.70673851 T T T # 217 O885
0.47026869 0.67533366 0.78422419 T T T # 218 Si
0.40617993 0.55817729 0.78266486 T T T # 219 C1
0.54848964 0.68295998 0.84033457 T T T # 220 C2
0.39130276 0.78048108 0.78458288 T T T # 221 C3
0.36470884 0.55093550 0.74768852 T T T # 222 H1
0.45365039 0.49647762 0.78346608 T T T # 223 H2
0.36007774 0.55317396 0.81581160 T T T # 224 H3
0.59859993 0.62509848 0.83837275 T T T # 225 H4
0.58558545 0.75201026 0.84201912 T T T # 226 H5
0.51041137 0.67694609 0.87587778 T T T # 227 H6
0.33797679 0.77372876 0.81468066 T T T # 228 H7
0.42988482 0.84826698 0.79228291 T T T # 229 H8
0.35629233 0.78554463 0.74680169 T T T # 230 H9
0.68273572 0.74244943 0.68517143 T T T # 231 H111
0.78471811 0.65524229 0.74655906 T T T # 232 Cl