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
0.00455633 0.16502387 0.59044001 T T T # 1 Ti1
0.17042315 0.33221946 0.27266532 F F F # 2 Ti2
0.00581770 0.16312117 0.45989167 T T T # 3 Ti3
0.17042315 0.33221946 0.39144741 F F F # 4 Ti4
0.00375648 0.16555279 0.33205637 F F F # 5 Ti5
0.17301031 0.33117932 0.50719175 T T T # 6 Ti6
0.00375648 0.16555279 0.21327428 F F F # 7 Ti7
0.17283258 0.33195019 0.62295282 T T T # 8 Ti8
0.00803419 0.49433190 0.58797689 T T T # 9 Ti9
0.17042315 0.66555279 0.27266532 F F F # 10 Ti10
0.00500066 0.49804988 0.45933872 T T T # 11 Ti11
0.17042315 0.66555279 0.39144741 F F F # 12 Ti12
0.00375648 0.49888613 0.33205637 F F F # 13 Ti13
0.17328962 0.66260244 0.50727789 T T T # 14 Ti14
0.00375648 0.49888613 0.21327428 F F F # 15 Ti15
0.17043882 0.66523540 0.62304250 T T T # 16 Ti16
0.00293333 0.83131477 0.59019473 T T T # 17 Ti17
0.17042315 0.99888613 0.27266532 F F F # 18 Ti18
0.00555886 0.82901941 0.46017242 T T T # 19 Ti19
0.17042315 0.99888613 0.39144741 F F F # 20 Ti20
0.00375648 0.83221946 0.33205637 F F F # 21 Ti21
0.17142598 0.99706449 0.50700906 T T T # 22 Ti22
0.00375648 0.83221946 0.21327428 F F F # 23 Ti23
0.17031933 0.99831820 0.62309406 T T T # 24 Ti24
0.33703710 0.16525958 0.58954166 T T T # 25 Ti25
0.50375648 0.33221946 0.27266532 F F F # 26 Ti26
0.33788969 0.16494742 0.45937228 T T T # 27 Ti27
0.50375648 0.33221946 0.39144741 F F F # 28 Ti28
0.33708981 0.16555279 0.33205637 F F F # 29 Ti29
0.50663323 0.32965494 0.50722669 T T T # 30 Ti30
0.33708981 0.16555279 0.21327428 F F F # 31 Ti31
0.50463320 0.33204401 0.62299380 T T T # 32 Ti32
0.34100292 0.50214632 0.59062343 T T T # 33 Ti33
0.50375648 0.66555279 0.27266532 F F F # 34 Ti34
0.34103316 0.49726949 0.46030211 T T T # 35 Ti35
0.50375648 0.66555279 0.39144741 F F F # 36 Ti36
0.33708981 0.49888613 0.33205637 F F F # 37 Ti37
0.50495960 0.66205841 0.51127509 T T T # 38 Ti38
0.33708981 0.49888613 0.21327428 F F F # 39 Ti39
0.50559161 0.66740706 0.63281320 T T T # 40 Ti40
0.33344457 0.83487083 0.58674718 T T T # 41 Ti41
0.50375648 0.99888613 0.27266532 F F F # 42 Ti42
0.33960063 0.82942057 0.45926631 T T T # 43 Ti43
0.50375648 0.99888613 0.39144741 F F F # 44 Ti44
0.33708981 0.83221946 0.33205637 F F F # 45 Ti45
0.50388194 0.99899020 0.50710553 T T T # 46 Ti46
0.33708981 0.83221946 0.21327428 F F F # 47 Ti47
0.50258320 0.99945156 0.62307693 T T T # 48 Ti48
0.67098916 0.16511724 0.58970570 T T T # 49 Ti49
0.83708981 0.33221946 0.27266532 F F F # 50 Ti50
0.67329960 0.16278257 0.45994732 T T T # 51 Ti51
0.83708981 0.33221946 0.39144741 F F F # 52 Ti52
0.67042315 0.16555279 0.33205637 F F F # 53 Ti53
0.84015859 0.32925151 0.50706096 T T T # 54 Ti54
0.67042315 0.16555279 0.21327428 F F F # 55 Ti55
0.83788188 0.33138543 0.62318031 T T T # 56 Ti56
0.67491933 0.49613319 0.58730384 T T T # 57 Ti57
0.83708981 0.66555279 0.27266532 F F F # 58 Ti58
0.67269524 0.49758321 0.45942616 T T T # 59 Ti59
0.83708981 0.66555279 0.39144741 F F F # 60 Ti60
0.67042315 0.49888613 0.33205637 F F F # 61 Ti61
0.83900088 0.66375272 0.50889631 T T T # 62 Ti62
0.67042315 0.49888613 0.21327428 F F F # 63 Ti63
0.84139078 0.66106285 0.62699677 T T T # 64 Ti64
0.66312374 0.83442815 0.58653581 T T T # 65 Ti65
0.83708981 0.99888613 0.27266532 F F F # 66 Ti66
0.67153997 0.82733577 0.45928763 T T T # 67 Ti67
0.83708981 0.99888613 0.39144741 F F F # 68 Ti68
0.67042315 0.83221946 0.33205637 F F F # 69 Ti69
0.83893537 0.99513234 0.50719198 T T T # 70 Ti70
0.67042315 0.83221946 0.21327428 F F F # 71 Ti71
0.83694917 0.99819447 0.62295208 T T T # 72 Ti72
0.10468442 0.26437977 0.57428283 T T T # 73 O1
0.26445648 0.23818613 0.27266532 F F F # 74 O2
0.07638981 0.09291946 0.27266532 F F F # 75 O3
0.23793084 0.06559503 0.57382181 T T T # 76 O4
0.10523724 0.26578618 0.45397347 T T T # 77 O5
0.26445648 0.23818613 0.39144741 F F F # 78 O6
0.07638981 0.09291946 0.39144741 F F F # 79 O7
0.23639455 0.06495404 0.45368051 T T T # 80 O8
0.09778981 0.25958613 0.33205637 F F F # 81 O9
0.27228202 0.23080003 0.51456623 T T T # 82 O10
0.07029460 0.09903943 0.51445124 T T T # 83 O11
0.24305648 0.07151946 0.33205637 F F F # 84 O12
0.09778981 0.25958613 0.21327428 F F F # 85 O13
0.26686096 0.23545279 0.63866583 T T T # 86 O14
0.07542149 0.09422713 0.63912568 T T T # 87 O15
0.24305648 0.07151946 0.21327428 F F F # 88 O16
0.10510901 0.59686811 0.57365476 T T T # 89 O17
0.26445648 0.57151946 0.27266532 F F F # 90 O18
0.07638981 0.42625279 0.27266532 F F F # 91 O19
0.23882670 0.39882784 0.57390080 T T T # 92 O20
0.10487920 0.59871730 0.45354063 T T T # 93 O21
0.26445648 0.57151946 0.39144741 F F F # 94 O22
0.07638981 0.42625279 0.39144741 F F F # 95 O23
0.23722478 0.39792841 0.45375989 T T T # 96 O24
0.09778981 0.59291946 0.33205637 F F F # 97 O25
0.27263129 0.56422790 0.51463417 T T T # 98 O26
0.07044186 0.43251829 0.51429926 T T T # 99 O27
0.24305648 0.40485279 0.33205637 F F F # 100 O28
0.09778981 0.59291946 0.21327428 F F F # 101 O29
0.26514276 0.57067471 0.63912638 T T T # 102 O30
0.07708347 0.42524124 0.63872238 T T T # 103 O31
0.24305648 0.40485279 0.21327428 F F F # 104 O32
0.10349346 0.93133721 0.57369358 T T T # 105 O33
0.26445648 0.90485279 0.27266532 F F F # 106 O34
0.07638981 0.75958613 0.27266532 F F F # 107 O35
0.23437901 0.73284514 0.57289700 T T T # 108 O36
0.10429688 0.93261392 0.45366232 T T T # 109 O37
0.26445648 0.90485279 0.39144741 F F F # 110 O38
0.07638981 0.75958613 0.39144741 F F F # 111 O39
0.23682304 0.73096909 0.45365049 T T T # 112 O40
0.09778981 0.92625279 0.33205637 F F F # 113 O41
0.27131791 0.89781280 0.51315382 T T T # 114 O42
0.06951344 0.76472486 0.51415650 T T T # 115 O43
0.24305648 0.73818613 0.33205637 F F F # 116 O44
0.09778981 0.92625279 0.21327428 F F F # 117 O45
0.26356667 0.90532377 0.63896381 T T T # 118 O46
0.07547205 0.76025950 0.63864792 T T T # 119 O47
0.24305648 0.73818613 0.21327428 F F F # 120 O48
0.43705687 0.26405190 0.57420184 T T T # 121 O49
0.59778981 0.23818613 0.27266532 F F F # 122 O50
0.40972315 0.09291946 0.27266532 F F F # 123 O51
0.57072287 0.06608304 0.57410777 T T T # 124 O52
0.43783771 0.26570892 0.45359391 T T T # 125 O53
0.59778981 0.23818613 0.39144741 F F F # 126 O54
0.40972315 0.09291946 0.39144741 F F F # 127 O55
0.57044132 0.06417369 0.45366930 T T T # 128 O56
0.43112315 0.25958613 0.33205637 F F F # 129 O57
0.60528022 0.22985205 0.51413928 T T T # 130 O58
0.40357981 0.09966995 0.51395158 T T T # 131 O59
0.57638981 0.07151946 0.33205637 F F F # 132 O60
0.43112315 0.25958613 0.21327428 F F F # 133 O61
0.59950451 0.23566590 0.63847569 T T T # 134 O62
0.40828168 0.09422187 0.63877718 T T T # 135 O63
0.57638981 0.07151946 0.21327428 F F F # 136 O64
0.43690808 0.59765417 0.57759987 T T T # 137 O65
0.59778981 0.57151946 0.27266532 F F F # 138 O66
0.40972315 0.42625279 0.27266532 F F F # 139 O67
0.57233003 0.39530468 0.57293709 T T T # 140 O68
0.43891092 0.59953326 0.45515135 T T T # 141 O69
0.59778981 0.57151946 0.39144741 F F F # 142 O70
0.40972315 0.42625279 0.39144741 F F F # 143 O71
0.57032994 0.39768599 0.45375601 T T T # 144 O72
0.43112315 0.59291946 0.33205637 F F F # 145 O73
0.60590649 0.56379345 0.51445390 T T T # 146 O74
0.40445734 0.43240591 0.51458113 T T T # 147 O75
0.57638981 0.40485279 0.33205637 F F F # 148 O76
0.43112315 0.59291946 0.21327428 F F F # 149 O77
0.60229559 0.56395103 0.63160866 T T T # 150 O78
0.40937384 0.42560246 0.63894279 T T T # 151 O79
0.57638981 0.40485279 0.21327428 F F F # 152 O80
0.43596898 0.93438555 0.57320478 T T T # 153 O81
0.59778981 0.90485279 0.27266532 F F F # 154 O82
0.40972315 0.75958613 0.27266532 F F F # 155 O83
0.57139856 0.73307664 0.57740437 T T T # 156 O84
0.43840274 0.93255837 0.45380346 T T T # 157 O85
0.59778981 0.90485279 0.39144741 F F F # 158 O86
0.40972315 0.75958613 0.39144741 F F F # 159 O87
0.56952028 0.73051607 0.45540738 T T T # 160 O88
0.43112315 0.92625279 0.33205637 F F F # 161 O89
0.60529625 0.89693215 0.51513974 T T T # 162 O90
0.40309402 0.76600767 0.51418026 T T T # 163 O91
0.57638981 0.73818613 0.33205637 F F F # 164 O92
0.43112315 0.92625279 0.21327428 F F F # 165 O93
0.59866208 0.90512497 0.63797762 T T T # 166 O94
0.40244709 0.76335395 0.63138884 T T T # 167 O95
0.57638981 0.73818613 0.21327428 F F F # 168 O96
0.77077971 0.26388694 0.57380413 T T T # 169 O97
0.93112315 0.23818613 0.27266532 F F F # 170 O98
0.74305648 0.09291946 0.27266532 F F F # 171 O99
0.90492202 0.06563028 0.57434861 T T T # 172 O100
0.77198925 0.26519552 0.45362914 T T T # 173 O101
0.93112315 0.23818613 0.39144741 F F F # 174 O102
0.74305648 0.09291946 0.39144741 F F F # 175 O103
0.90365732 0.06411052 0.45390846 T T T # 176 O104
0.76445648 0.25958613 0.33205637 F F F # 177 O105
0.93893867 0.23039420 0.51432502 T T T # 178 O106
0.73686369 0.09867937 0.51448442 T T T # 179 O107
0.90972315 0.07151946 0.33205637 F F F # 180 O108
0.76445648 0.25958613 0.21327428 F F F # 181 O109
0.93355310 0.23554951 0.63903009 T T T # 182 O110
0.74199089 0.09364918 0.63850142 T T T # 183 O111
0.90972315 0.07151946 0.21327428 F F F # 184 O112
0.77380886 0.59760836 0.57530766 T T T # 185 O113
0.93112315 0.57151946 0.27266532 F F F # 186 O114
0.74305648 0.42625279 0.27266532 F F F # 187 O115
0.90565805 0.39707851 0.57339223 T T T # 188 O116
0.77178457 0.59974381 0.45440028 T T T # 189 O117
0.93112315 0.57151946 0.39144741 F F F # 190 O118
0.74305648 0.42625279 0.39144741 F F F # 191 O119
0.90406069 0.39744428 0.45360927 T T T # 192 O120
0.76445648 0.59291946 0.33205637 F F F # 193 O121
0.93894256 0.56419985 0.51374874 T T T # 194 O122
0.73795079 0.43194631 0.51324262 T T T # 195 O123
0.90972315 0.40485279 0.33205637 F F F # 196 O124
0.76445648 0.59291946 0.21327428 F F F # 197 O125
0.93723176 0.56657760 0.63535962 T T T # 198 O126
0.74504142 0.42391254 0.63900838 T T T # 199 O127
0.90972315 0.40485279 0.21327428 F F F # 200 O128
0.77070868 0.93219134 0.57356298 T T T # 201 O129
0.93112315 0.90485279 0.27266532 F F F # 202 O130
0.74305648 0.75958613 0.27266532 F F F # 203 O131
0.90456580 0.73228815 0.57622788 T T T # 204 O132
0.77115385 0.93197703 0.45377547 T T T # 205 O133
0.93112315 0.90485279 0.39144741 F F F # 206 O134
0.74305648 0.75958613 0.39144741 F F F # 207 O135
0.90293984 0.73109850 0.45427307 T T T # 208 O136
0.76445648 0.92625279 0.33205637 F F F # 209 O137
0.93841466 0.89670557 0.51484851 T T T # 210 O138
0.73636058 0.76556841 0.51446910 T T T # 211 O139
0.90972315 0.73818613 0.33205637 F F F # 212 O140
0.76445648 0.92625279 0.21327428 F F F # 213 O141
0.93337759 0.90432919 0.63869514 T T T # 214 O142
0.74206458 0.76361980 0.63746442 T T T # 215 O143
0.90972315 0.73818613 0.21327428 F F F # 216 O144
0.51384587 0.67553250 0.70599648 T T T # 217 O885
0.46473749 0.66705081 0.80756513 T T T # 218 Si
0.40063341 0.55340831 0.79596745 T T T # 219 C1
0.51094418 0.67344827 0.87099693 T T T # 220 C2
0.39955338 0.77617726 0.79620214 T T T # 221 C3
0.37698629 0.54855701 0.75749731 T T T # 222 H1
0.44170082 0.48948832 0.80247210 T T T # 223 H2
0.34283066 0.55117149 0.82064463 T T T # 224 H3
0.55338329 0.61250170 0.87661805 T T T # 225 H4
0.54939664 0.73989514 0.87798852 T T T # 226 H5
0.45873175 0.67249065 0.89810206 T T T # 227 H6
0.33748432 0.77653540 0.81877635 T T T # 228 H7
0.43935699 0.84178752 0.80667809 T T T # 229 H8
0.38047822 0.77808111 0.75602063 T T T # 230 H9
0.63534951 0.70095445 0.70015156 T T T # 231 H111
0.71674686 0.64785365 0.77719446 T T T # 232 Cl