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
0.00427456 0.16472739 0.59088886 T T T # 1 Ti1
0.17001300 0.33199669 0.27311342 F F F # 2 Ti2
0.00526428 0.16295401 0.46033315 T T T # 3 Ti3
0.17001300 0.33199669 0.39189551 F F F # 4 Ti4
0.00334633 0.16533002 0.33250447 F F F # 5 Ti5
0.17234529 0.33111255 0.50762936 T T T # 6 Ti6
0.00334633 0.16533002 0.21372238 F F F # 7 Ti7
0.17265693 0.33166242 0.62336495 T T T # 8 Ti8
0.00833388 0.49337833 0.58806710 T T T # 9 Ti9
0.17001300 0.66533002 0.27311342 F F F # 10 Ti10
0.00420284 0.49823220 0.45966529 T T T # 11 Ti11
0.17001300 0.66533002 0.39189551 F F F # 12 Ti12
0.00334633 0.49866336 0.33250447 F F F # 13 Ti13
0.17285202 0.66241446 0.50772174 T T T # 14 Ti14
0.00334633 0.49866336 0.21372238 F F F # 15 Ti15
0.16997541 0.66495618 0.62344579 T T T # 16 Ti16
0.00226705 0.83094939 0.59074207 T T T # 17 Ti17
0.17001300 0.99866336 0.27311342 F F F # 18 Ti18
0.00502351 0.82869494 0.46065025 T T T # 19 Ti19
0.17001300 0.99866336 0.39189551 F F F # 20 Ti20
0.00334633 0.83199669 0.33250447 F F F # 21 Ti21
0.17081997 0.99685731 0.50746276 T T T # 22 Ti22
0.00334633 0.83199669 0.21372238 F F F # 23 Ti23
0.16992760 0.99795102 0.62352367 T T T # 24 Ti24
0.33653944 0.16510109 0.58995963 T T T # 25 Ti25
0.50334633 0.33199669 0.27311342 F F F # 26 Ti26
0.33706529 0.16509896 0.45969727 T T T # 27 Ti27
0.50334633 0.33199669 0.39189551 F F F # 28 Ti28
0.33667966 0.16533002 0.33250447 F F F # 29 Ti29
0.50627670 0.32946642 0.50766102 T T T # 30 Ti30
0.33667966 0.16533002 0.21372238 F F F # 31 Ti31
0.50424232 0.33192523 0.62338232 T T T # 32 Ti32
0.34070679 0.50210897 0.59096398 T T T # 33 Ti33
0.50334633 0.66533002 0.27311342 F F F # 34 Ti34
0.34056433 0.49698805 0.46071039 T T T # 35 Ti35
0.50334633 0.66533002 0.39189551 F F F # 36 Ti36
0.33667966 0.49866336 0.33250447 F F F # 37 Ti37
0.50414337 0.66169280 0.51176691 T T T # 38 Ti38
0.33667966 0.49866336 0.21372238 F F F # 39 Ti39
0.50579591 0.66735320 0.63329396 T T T # 40 Ti40
0.33298905 0.83450805 0.58717903 T T T # 41 Ti41
0.50334633 0.99866336 0.27311342 F F F # 42 Ti42
0.33902557 0.82930719 0.45968949 T T T # 43 Ti43
0.50334633 0.99866336 0.39189551 F F F # 44 Ti44
0.33667966 0.83199669 0.33250447 F F F # 45 Ti45
0.50285755 0.99940766 0.50751877 T T T # 46 Ti46
0.33667966 0.83199669 0.21372238 F F F # 47 Ti47
0.50192023 0.99946804 0.62348992 T T T # 48 Ti48
0.67052893 0.16497640 0.59013358 T T T # 49 Ti49
0.83667966 0.33199669 0.27311342 F F F # 50 Ti50
0.67293598 0.16258049 0.46038242 T T T # 51 Ti51
0.83667966 0.33199669 0.39189551 F F F # 52 Ti52
0.67001300 0.16533002 0.33250447 F F F # 53 Ti53
0.83965597 0.32913332 0.50751037 T T T # 54 Ti54
0.67001300 0.16533002 0.21372238 F F F # 55 Ti55
0.83757787 0.33107613 0.62361704 T T T # 56 Ti56
0.67473526 0.49597221 0.58779332 T T T # 57 Ti57
0.83667966 0.66533002 0.27311342 F F F # 58 Ti58
0.67224217 0.49758427 0.45991460 T T T # 59 Ti59
0.83667966 0.66533002 0.39189551 F F F # 60 Ti60
0.67001300 0.49866336 0.33250447 F F F # 61 Ti61
0.83832748 0.66373706 0.50967007 T T T # 62 Ti62
0.67001300 0.49866336 0.21372238 F F F # 63 Ti63
0.84171323 0.66011206 0.62820806 T T T # 64 Ti64
0.66173472 0.83536649 0.58614507 T T T # 65 Ti65
0.83667966 0.99866336 0.27311342 F F F # 66 Ti66
0.67099612 0.82696965 0.45950819 T T T # 67 Ti67
0.83667966 0.99866336 0.39189551 F F F # 68 Ti68
0.67001300 0.83199669 0.33250447 F F F # 69 Ti69
0.83852207 0.99486428 0.50761840 T T T # 70 Ti70
0.67001300 0.83199669 0.21372238 F F F # 71 Ti71
0.83654669 0.99807854 0.62336052 T T T # 72 Ti72
0.10436388 0.26414414 0.57469149 T T T # 73 O1
0.26404633 0.23796336 0.27311342 F F F # 74 O2
0.07597966 0.09269669 0.27311342 F F F # 75 O3
0.23755486 0.06534553 0.57427277 T T T # 76 O4
0.10482414 0.26556975 0.45439563 T T T # 77 O5
0.26404633 0.23796336 0.39189551 F F F # 78 O6
0.07597966 0.09269669 0.39189551 F F F # 79 O7
0.23591712 0.06478317 0.45412585 T T T # 80 O8
0.09737966 0.25936336 0.33250447 F F F # 81 O9
0.27181202 0.23060590 0.51499420 T T T # 82 O10
0.06983615 0.09885952 0.51491343 T T T # 83 O11
0.24264633 0.07129669 0.33250447 F F F # 84 O12
0.09737966 0.25936336 0.21372238 F F F # 85 O13
0.26659446 0.23517871 0.63915862 T T T # 86 O14
0.07508614 0.09401097 0.63955989 T T T # 87 O15
0.24264633 0.07129669 0.21372238 F F F # 88 O16
0.10495503 0.59648735 0.57397422 T T T # 89 O17
0.26404633 0.57129669 0.27311342 F F F # 90 O18
0.07597966 0.42603002 0.27311342 F F F # 91 O19
0.23848129 0.39862673 0.57428250 T T T # 92 O20
0.10441872 0.59849767 0.45395779 T T T # 93 O21
0.26404633 0.57129669 0.39189551 F F F # 94 O22
0.07597966 0.42603002 0.39189551 F F F # 95 O23
0.23678444 0.39768284 0.45419228 T T T # 96 O24
0.09737966 0.59269669 0.33250447 F F F # 97 O25
0.27226058 0.56403268 0.51502050 T T T # 98 O26
0.06995142 0.43233405 0.51467652 T T T # 99 O27
0.24264633 0.40463002 0.33250447 F F F # 100 O28
0.09737966 0.59269669 0.21372238 F F F # 101 O29
0.26486310 0.57058215 0.63953622 T T T # 102 O30
0.07697621 0.42472313 0.63920041 T T T # 103 O31
0.24264633 0.40463002 0.21372238 F F F # 104 O32
0.10307819 0.93106213 0.57411776 T T T # 105 O33
0.26404633 0.90463002 0.27311342 F F F # 106 O34
0.07597966 0.75936336 0.27311342 F F F # 107 O35
0.23380344 0.73266146 0.57326798 T T T # 108 O36
0.10382034 0.93237723 0.45409886 T T T # 109 O37
0.26404633 0.90463002 0.39189551 F F F # 110 O38
0.07597966 0.75936336 0.39189551 F F F # 111 O39
0.23638312 0.73076816 0.45406578 T T T # 112 O40
0.09737966 0.92603002 0.33250447 F F F # 113 O41
0.27083622 0.89762920 0.51353676 T T T # 114 O42
0.06899144 0.76439734 0.51459690 T T T # 115 O43
0.24264633 0.73796336 0.33250447 F F F # 116 O44
0.09737966 0.92603002 0.21372238 F F F # 117 O45
0.26316450 0.90505333 0.63944138 T T T # 118 O46
0.07508751 0.75997240 0.63909748 T T T # 119 O47
0.24264633 0.73796336 0.21372238 F F F # 120 O48
0.43660808 0.26384191 0.57463375 T T T # 121 O49
0.59737966 0.23796336 0.27311342 F F F # 122 O50
0.40931300 0.09269669 0.27311342 F F F # 123 O51
0.57012408 0.06600648 0.57451294 T T T # 124 O52
0.43736175 0.26550577 0.45402097 T T T # 125 O53
0.59737966 0.23796336 0.39189551 F F F # 126 O54
0.40931300 0.09269669 0.39189551 F F F # 127 O55
0.57000191 0.06394626 0.45411200 T T T # 128 O56
0.43071300 0.25936336 0.33250447 F F F # 129 O57
0.60485426 0.22961399 0.51456546 T T T # 130 O58
0.40307251 0.09953588 0.51434188 T T T # 131 O59
0.57597966 0.07129669 0.33250447 F F F # 132 O60
0.43071300 0.25936336 0.21372238 F F F # 133 O61
0.59906203 0.23547972 0.63890555 T T T # 134 O62
0.40778722 0.09409335 0.63925619 T T T # 135 O63
0.57597966 0.07129669 0.21372238 F F F # 136 O64
0.43655583 0.59760388 0.57793673 T T T # 137 O65
0.59737966 0.57129669 0.27311342 F F F # 138 O66
0.40931300 0.42603002 0.27311342 F F F # 139 O67
0.57196275 0.39501082 0.57329231 T T T # 140 O68
0.43845503 0.59929002 0.45553699 T T T # 141 O69
0.59737966 0.57129669 0.39189551 F F F # 142 O70
0.40931300 0.42603002 0.39189551 F F F # 143 O71
0.56994175 0.39748418 0.45419270 T T T # 144 O72
0.43071300 0.59269669 0.33250447 F F F # 145 O73
0.60547424 0.56368857 0.51487659 T T T # 146 O74
0.40405648 0.43222062 0.51499113 T T T # 147 O75
0.57597966 0.40463002 0.33250447 F F F # 148 O76
0.43071300 0.59269669 0.21372238 F F F # 149 O77
0.60128869 0.56328759 0.63202711 T T T # 150 O78
0.40900718 0.42553530 0.63929418 T T T # 151 O79
0.57597966 0.40463002 0.21372238 F F F # 152 O80
0.43543397 0.93424173 0.57364997 T T T # 153 O81
0.59737966 0.90463002 0.27311342 F F F # 154 O82
0.40931300 0.75936336 0.27311342 F F F # 155 O83
0.57080763 0.73299463 0.57777636 T T T # 156 O84
0.43797829 0.93238565 0.45424712 T T T # 157 O85
0.59737966 0.90463002 0.39189551 F F F # 158 O86
0.40931300 0.75936336 0.39189551 F F F # 159 O87
0.56906123 0.73035257 0.45584782 T T T # 160 O88
0.43071300 0.92603002 0.33250447 F F F # 161 O89
0.60488581 0.89672691 0.51564177 T T T # 162 O90
0.40262765 0.76582195 0.51458799 T T T # 163 O91
0.57597966 0.73796336 0.33250447 F F F # 164 O92
0.43071300 0.92603002 0.21372238 F F F # 165 O93
0.59814313 0.90504791 0.63822426 T T T # 166 O94
0.40169996 0.76275187 0.63171996 T T T # 167 O95
0.57597966 0.73796336 0.21372238 F F F # 168 O96
0.77036912 0.26363304 0.57424412 T T T # 169 O97
0.93071300 0.23796336 0.27311342 F F F # 170 O98
0.74264633 0.09269669 0.27311342 F F F # 171 O99
0.90453824 0.06550417 0.57476839 T T T # 172 O100
0.77153298 0.26501769 0.45406072 T T T # 173 O101
0.93071300 0.23796336 0.39189551 F F F # 174 O102
0.74264633 0.09269669 0.39189551 F F F # 175 O103
0.90325541 0.06388871 0.45431941 T T T # 176 O104
0.76404633 0.25936336 0.33250447 F F F # 177 O105
0.93847858 0.23022022 0.51469267 T T T # 178 O106
0.73644406 0.09848463 0.51489701 T T T # 179 O107
0.90931300 0.07129669 0.33250447 F F F # 180 O108
0.76404633 0.25936336 0.21372238 F F F # 181 O109
0.93316981 0.23526538 0.63946915 T T T # 182 O110
0.74147467 0.09341245 0.63892086 T T T # 183 O111
0.90931300 0.07129669 0.21372238 F F F # 184 O112
0.77330977 0.59751023 0.57619821 T T T # 185 O113
0.93071300 0.57129669 0.27311342 F F F # 186 O114
0.74264633 0.42603002 0.27311342 F F F # 187 O115
0.90535070 0.39657837 0.57375270 T T T # 188 O116
0.77136430 0.59965226 0.45496331 T T T # 189 O117
0.93071300 0.57129669 0.39189551 F F F # 190 O118
0.74264633 0.42603002 0.39189551 F F F # 191 O119
0.90359413 0.39728593 0.45403776 T T T # 192 O120
0.76404633 0.59269669 0.33250447 F F F # 193 O121
0.93839550 0.56404396 0.51410287 T T T # 194 O122
0.73754039 0.43184624 0.51375678 T T T # 195 O123
0.90931300 0.40463002 0.33250447 F F F # 196 O124
0.76404633 0.59269669 0.21372238 F F F # 197 O125
0.93751467 0.56576111 0.63517237 T T T # 198 O126
0.74465062 0.42358633 0.63942201 T T T # 199 O127
0.90931300 0.40463002 0.21372238 F F F # 200 O128
0.77031414 0.93222675 0.57387888 T T T # 201 O129
0.93071300 0.90463002 0.27311342 F F F # 202 O130
0.74264633 0.75936336 0.27311342 F F F # 203 O131
0.90400941 0.73209329 0.57707035 T T T # 204 O132
0.77069870 0.93174338 0.45420532 T T T # 205 O133
0.93071300 0.90463002 0.39189551 F F F # 206 O134
0.74264633 0.75936336 0.39189551 F F F # 207 O135
0.90236421 0.73084774 0.45485073 T T T # 208 O136
0.76404633 0.92603002 0.33250447 F F F # 209 O137
0.93794682 0.89645026 0.51532270 T T T # 210 O138
0.73577946 0.76547359 0.51487178 T T T # 211 O139
0.90931300 0.73796336 0.33250447 F F F # 212 O140
0.76404633 0.92603002 0.21372238 F F F # 213 O141
0.93294704 0.90432718 0.63918490 T T T # 214 O142
0.74125262 0.76417695 0.63758467 T T T # 215 O143
0.90931300 0.73796336 0.21372238 F F F # 216 O144
0.51577444 0.67818109 0.70624382 T T T # 217 O885
0.46658122 0.66981176 0.79978482 T T T # 218 Si
0.40248225 0.55499797 0.79153325 T T T # 219 C1
0.52345933 0.67661884 0.86077615 T T T # 220 C2
0.39680317 0.77761187 0.79232906 T T T # 221 C3
0.37289381 0.54934984 0.75422771 T T T # 222 H1
0.44568401 0.49181809 0.79613676 T T T # 223 H2
0.34857969 0.55183898 0.81903362 T T T # 224 H3
0.56845550 0.61670063 0.86386962 T T T # 225 H4
0.56145958 0.74393351 0.86599872 T T T # 226 H5
0.47595829 0.67397579 0.89069397 T T T # 227 H6
0.33764848 0.77559985 0.81741112 T T T # 228 H7
0.43619960 0.84394734 0.80187970 T T T # 229 H8
0.37241626 0.78056895 0.75294765 T T T # 230 H9
0.65114491 0.71478611 0.69515818 T T T # 231 H111
0.73940394 0.65031653 0.76698266 T T T # 232 Cl