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 N C H
72 145 1 1 5 16
Selective dynamics
Direct
0.00008792 0.16320812 0.59262555 T T T # 1 Ti1
0.16629794 0.33020029 0.27491802 F F F # 2 Ti2
0.99917891 0.16391080 0.46211978 T T T # 3 Ti3
0.16629794 0.33020029 0.39370011 F F F # 4 Ti4
0.99963127 0.16353362 0.33430907 F F F # 5 Ti5
0.16712487 0.33093739 0.50944122 T T T # 6 Ti6
0.99963127 0.16353362 0.21552698 F F F # 7 Ti7
0.16730331 0.33070155 0.62520996 T T T # 8 Ti8
0.00108826 0.49492239 0.59086253 T T T # 9 Ti9
0.16629794 0.66353362 0.27491802 F F F # 10 Ti10
0.99941487 0.49731165 0.46198161 T T T # 11 Ti11
0.16629794 0.66353362 0.39370011 F F F # 12 Ti12
0.99963127 0.49686696 0.33430907 F F F # 13 Ti13
0.16558355 0.66385257 0.50945791 T T T # 14 Ti14
0.99963127 0.49686696 0.21552698 F F F # 15 Ti15
0.16597009 0.66353896 0.62518469 T T T # 16 Ti16
0.99811469 0.82918970 0.59264367 T T T # 17 Ti17
0.16629794 0.99686696 0.27491802 F F F # 18 Ti18
0.99859736 0.83042606 0.46247931 T T T # 19 Ti19
0.16629794 0.99686696 0.39370011 F F F # 20 Ti20
0.99963127 0.83020029 0.33430907 F F F # 21 Ti21
0.16468652 0.99779733 0.50932163 T T T # 22 Ti22
0.99963127 0.83020029 0.21552698 F F F # 23 Ti23
0.16557346 0.99640460 0.62541664 T T T # 24 Ti24
0.33224874 0.16321860 0.59215298 T T T # 25 Ti25
0.49963127 0.33020029 0.27491802 F F F # 26 Ti26
0.33262343 0.16396856 0.46211802 T T T # 27 Ti27
0.49963127 0.33020029 0.39370011 F F F # 28 Ti28
0.33296460 0.16353362 0.33430907 F F F # 29 Ti29
0.49918298 0.33074841 0.50941193 T T T # 30 Ti30
0.33296460 0.16353362 0.21552698 F F F # 31 Ti31
0.49948960 0.32955412 0.62528278 T T T # 32 Ti32
0.33616685 0.49990188 0.59308078 T T T # 33 Ti33
0.49963127 0.66353362 0.27491802 F F F # 34 Ti34
0.33372206 0.49851726 0.46278299 T T T # 35 Ti35
0.49963127 0.66353362 0.39370011 F F F # 36 Ti36
0.33296460 0.49686696 0.33430907 F F F # 37 Ti37
0.49870587 0.66347155 0.51331297 T T T # 38 Ti38
0.33296460 0.49686696 0.21552698 F F F # 39 Ti39
0.50025937 0.66512107 0.63486459 T T T # 40 Ti40
0.32910157 0.83336324 0.58908951 T T T # 41 Ti41
0.49963127 0.99686696 0.27491802 F F F # 42 Ti42
0.33280281 0.83011435 0.46148826 T T T # 43 Ti43
0.49963127 0.99686696 0.39370011 F F F # 44 Ti44
0.33296460 0.83020029 0.33430907 F F F # 45 Ti45
0.49906661 0.99724431 0.50943978 T T T # 46 Ti46
0.33296460 0.83020029 0.21552698 F F F # 47 Ti47
0.49875554 0.99696833 0.62541657 T T T # 48 Ti48
0.66594333 0.16312494 0.59183338 T T T # 49 Ti49
0.83296460 0.33020029 0.27491802 F F F # 50 Ti50
0.66578201 0.16360604 0.46213504 T T T # 51 Ti51
0.83296460 0.33020029 0.39370011 F F F # 52 Ti52
0.66629794 0.16353362 0.33430907 F F F # 53 Ti53
0.83318555 0.32970381 0.50913001 T T T # 54 Ti54
0.66629794 0.16353362 0.21552698 F F F # 55 Ti55
0.83324570 0.32899651 0.62507910 T T T # 56 Ti56
0.66954318 0.49336539 0.58932996 T T T # 57 Ti57
0.83296460 0.66353362 0.27491802 F F F # 58 Ti58
0.66594386 0.49817636 0.46164931 T T T # 59 Ti59
0.83296460 0.66353362 0.39370011 F F F # 60 Ti60
0.66629794 0.49686696 0.33430907 F F F # 61 Ti61
0.83301588 0.66447981 0.51059750 T T T # 62 Ti62
0.66629794 0.49686696 0.21552698 F F F # 63 Ti63
0.83185280 0.66097556 0.62805889 T T T # 64 Ti64
0.66217887 0.82937315 0.59182074 T T T # 65 Ti65
0.83296460 0.99686696 0.27491802 F F F # 66 Ti66
0.66468877 0.82879528 0.46243267 T T T # 67 Ti67
0.83296460 0.99686696 0.39370011 F F F # 68 Ti68
0.66629794 0.83020029 0.33430907 F F F # 69 Ti69
0.83164237 0.99643732 0.50939777 T T T # 70 Ti70
0.66629794 0.83020029 0.21552698 F F F # 71 Ti71
0.83206575 0.99668929 0.62509828 T T T # 72 Ti72
0.09946922 0.26280766 0.57658920 T T T # 73 O1
0.26033127 0.23616696 0.27491802 F F F # 74 O2
0.07226460 0.09090029 0.27491802 F F F # 75 O3
0.23278596 0.06390870 0.57616879 T T T # 76 O4
0.10050609 0.26418167 0.45625383 T T T # 77 O5
0.26033127 0.23616696 0.39370011 F F F # 78 O6
0.07226460 0.09090029 0.39370011 F F F # 79 O7
0.23164142 0.06318382 0.45606259 T T T # 80 O8
0.09366460 0.25756696 0.33430907 F F F # 81 O9
0.26712059 0.22940647 0.51684452 T T T # 82 O10
0.06507926 0.09787057 0.51693406 T T T # 83 O11
0.23893127 0.06950029 0.33430907 F F F # 84 O12
0.09366460 0.25756696 0.21552698 F F F # 85 O13
0.26135560 0.23415787 0.64102644 T T T # 86 O14
0.07045046 0.09236287 0.64151359 T T T # 87 O15
0.23893127 0.06950029 0.21552698 F F F # 88 O16
0.09975557 0.59582419 0.57601593 T T T # 89 O17
0.26033127 0.56950029 0.27491802 F F F # 90 O18
0.07226460 0.42423362 0.27491802 F F F # 91 O19
0.23375011 0.39747960 0.57629720 T T T # 92 O20
0.10023108 0.59726692 0.45584752 T T T # 93 O21
0.26033127 0.56950029 0.39370011 F F F # 94 O22
0.07226460 0.42423362 0.39370011 F F F # 95 O23
0.23256155 0.39651288 0.45610132 T T T # 96 O24
0.09366460 0.59090029 0.33430907 F F F # 97 O25
0.26735363 0.56330343 0.51705582 T T T # 98 O26
0.06555824 0.43106658 0.51661941 T T T # 99 O27
0.23893127 0.40283362 0.33430907 F F F # 100 O28
0.09366460 0.59090029 0.21552698 F F F # 101 O29
0.25996408 0.56886676 0.64154286 T T T # 102 O30
0.07150793 0.42432472 0.64091550 T T T # 103 O31
0.23893127 0.40283362 0.21552698 F F F # 104 O32
0.09826778 0.92946285 0.57625430 T T T # 105 O33
0.26033127 0.90283362 0.27491802 F F F # 106 O34
0.07226460 0.75756696 0.27491802 F F F # 107 O35
0.22973342 0.73158913 0.57530633 T T T # 108 O36
0.09952324 0.93114871 0.45599832 T T T # 109 O37
0.26033127 0.90283362 0.39370011 F F F # 110 O38
0.07226460 0.75756696 0.39370011 F F F # 111 O39
0.23195020 0.72965305 0.45601119 T T T # 112 O40
0.09366460 0.92423362 0.33430907 F F F # 113 O41
0.26621366 0.89653643 0.51556722 T T T # 114 O42
0.06424719 0.76385638 0.51668367 T T T # 115 O43
0.23893127 0.73616696 0.33430907 F F F # 116 O44
0.09366460 0.92423362 0.21552698 F F F # 117 O45
0.25894853 0.90369623 0.64149259 T T T # 118 O46
0.07047892 0.75842940 0.64153283 T T T # 119 O47
0.23893127 0.73616696 0.21552698 F F F # 120 O48
0.43178315 0.26243118 0.57643890 T T T # 121 O49
0.59366460 0.23616696 0.27491802 F F F # 122 O50
0.40559794 0.09090029 0.27491802 F F F # 123 O51
0.56638044 0.06420642 0.57630642 T T T # 124 O52
0.43320159 0.26420332 0.45594672 T T T # 125 O53
0.59366460 0.23616696 0.39370011 F F F # 126 O54
0.40559794 0.09090029 0.39370011 F F F # 127 O55
0.56561764 0.06272809 0.45592221 T T T # 128 O56
0.42699794 0.25756696 0.33430907 F F F # 129 O57
0.60006724 0.22881363 0.51647739 T T T # 130 O58
0.39863587 0.09808115 0.51644099 T T T # 131 O59
0.57226460 0.06950029 0.33430907 F F F # 132 O60
0.42699794 0.25756696 0.21552698 F F F # 133 O61
0.59446863 0.23377448 0.64088003 T T T # 134 O62
0.40352549 0.09259785 0.64107574 T T T # 135 O63
0.57226460 0.06950029 0.21552698 F F F # 136 O64
0.43209938 0.59587494 0.58044293 T T T # 137 O65
0.59366460 0.56950029 0.27491802 F F F # 138 O66
0.40559794 0.42423362 0.27491802 F F F # 139 O67
0.56723333 0.39366512 0.57549318 T T T # 140 O68
0.43415849 0.59814745 0.45759704 T T T # 141 O69
0.59366460 0.56950029 0.39370011 F F F # 142 O70
0.40559794 0.42423362 0.39370011 F F F # 143 O71
0.56542713 0.39630791 0.45606779 T T T # 144 O72
0.42699794 0.59090029 0.33430907 F F F # 145 O73
0.60086409 0.56208856 0.51694382 T T T # 146 O74
0.39916586 0.43146468 0.51723569 T T T # 147 O75
0.57226460 0.40283362 0.33430907 F F F # 148 O76
0.42699794 0.59090029 0.21552698 F F F # 149 O77
0.59907147 0.56249706 0.63437749 T T T # 150 O78
0.40461354 0.42376505 0.64156526 T T T # 151 O79
0.57226460 0.40283362 0.21552698 F F F # 152 O80
0.43144575 0.93231384 0.57548734 T T T # 153 O81
0.59366460 0.90283362 0.27491802 F F F # 154 O82
0.40559794 0.75756696 0.27491802 F F F # 155 O83
0.56606278 0.73139459 0.58006603 T T T # 156 O84
0.43341867 0.93092046 0.45599298 T T T # 157 O85
0.59366460 0.90283362 0.39370011 F F F # 158 O86
0.40559794 0.75756696 0.39370011 F F F # 159 O87
0.56478638 0.72872603 0.45779256 T T T # 160 O88
0.42699794 0.92423362 0.33430907 F F F # 161 O89
0.59983465 0.89594260 0.51678144 T T T # 162 O90
0.39793005 0.76464634 0.51662843 T T T # 163 O91
0.57226460 0.73616696 0.33430907 F F F # 164 O92
0.42699794 0.92423362 0.21552698 F F F # 165 O93
0.59352389 0.90429476 0.64168775 T T T # 166 O94
0.39783095 0.76197352 0.63419152 T T T # 167 O95
0.57226460 0.73616696 0.21552698 F F F # 168 O96
0.76567730 0.26212506 0.57587931 T T T # 169 O97
0.92699794 0.23616696 0.27491802 F F F # 170 O98
0.73893127 0.09090029 0.27491802 F F F # 171 O99
0.90024167 0.06393718 0.57661504 T T T # 172 O100
0.76718556 0.26362983 0.45581977 T T T # 173 O101
0.92699794 0.23616696 0.39370011 F F F # 174 O102
0.73893127 0.09090029 0.39370011 F F F # 175 O103
0.89896910 0.06266181 0.45622420 T T T # 176 O104
0.76033127 0.25756696 0.33430907 F F F # 177 O105
0.93373799 0.22917812 0.51663859 T T T # 178 O106
0.73166284 0.09770243 0.51676352 T T T # 179 O107
0.90559794 0.06950029 0.33430907 F F F # 180 O108
0.76033127 0.25756696 0.21552698 F F F # 181 O109
0.92867985 0.23385194 0.64142947 T T T # 182 O110
0.73747588 0.09243125 0.64083528 T T T # 183 O111
0.90559794 0.06950029 0.21552698 F F F # 184 O112
0.76855319 0.59487144 0.57668239 T T T # 185 O113
0.92699794 0.56950029 0.27491802 F F F # 186 O114
0.73893127 0.42423362 0.27491802 F F F # 187 O115
0.90045288 0.39594451 0.57573383 T T T # 188 O116
0.76720178 0.59806905 0.45670573 T T T # 189 O117
0.92699794 0.56950029 0.39370011 F F F # 190 O118
0.73893127 0.42423362 0.39370011 F F F # 191 O119
0.89930748 0.39583064 0.45590757 T T T # 192 O120
0.76033127 0.59090029 0.33430907 F F F # 193 O121
0.93429168 0.56269168 0.51646611 T T T # 194 O122
0.73256767 0.43028528 0.51552866 T T T # 195 O123
0.90559794 0.40283362 0.33430907 F F F # 196 O124
0.76033127 0.59090029 0.21552698 F F F # 197 O125
0.93109167 0.56630251 0.63887945 T T T # 198 O126
0.74035101 0.42188713 0.64166872 T T T # 199 O127
0.90559794 0.40283362 0.21552698 F F F # 200 O128
0.76523740 0.93100738 0.57594739 T T T # 201 O129
0.92699794 0.90283362 0.27491802 F F F # 202 O130
0.73893127 0.75756696 0.27491802 F F F # 203 O131
0.90022301 0.73041805 0.57843614 T T T # 204 O132
0.76653782 0.93060052 0.45606847 T T T # 205 O133
0.92699794 0.90283362 0.39370011 F F F # 206 O134
0.73893127 0.75756696 0.39370011 F F F # 207 O135
0.89864771 0.72967471 0.45636551 T T T # 208 O136
0.76033127 0.92423362 0.33430907 F F F # 209 O137
0.93306912 0.89558774 0.51715866 T T T # 210 O138
0.73175023 0.76410434 0.51707162 T T T # 211 O139
0.90559794 0.73616696 0.33430907 F F F # 212 O140
0.76033127 0.92423362 0.21552698 F F F # 213 O141
0.92762833 0.90187682 0.64147925 T T T # 214 O142
0.73745120 0.76121605 0.63863874 T T T # 215 O143
0.90559794 0.73616696 0.21552698 F F F # 216 O144
0.50757103 0.67088255 0.70897883 T T T # 217 O885
0.46534976 0.68990669 0.79314608 T T T # 218 Si
0.74157491 0.65072690 0.75104631 T T T # 219 N
0.36731246 0.60241060 0.79399244 T T T # 220 C1
0.53129386 0.67230836 0.85432267 T T T # 221 C2
0.42427059 0.81613873 0.78627237 T T T # 222 C3
0.80237828 0.72609259 0.76353561 T T T # 223 C4
0.76109350 0.55705455 0.76892317 T T T # 224 C5
0.33050649 0.60540807 0.75660029 T T T # 225 H1
0.39080850 0.52813381 0.80090479 T T T # 226 H2
0.31770715 0.61863429 0.82484582 T T T # 227 H3
0.55820971 0.59935377 0.85793271 T T T # 228 H4
0.58892790 0.72359767 0.85598794 T T T # 229 H5
0.48743637 0.68275881 0.88781752 T T T # 230 H6
0.37891220 0.83098820 0.81732962 T T T # 231 H7
0.47951760 0.86764486 0.78652247 T T T # 232 H8
0.38814331 0.82803066 0.75053245 T T T # 233 H9
0.81110599 0.73370781 0.80063501 T T T # 234 H10
0.86081862 0.70774160 0.74762513 T T T # 235 H11
0.78407714 0.79539738 0.75079349 T T T # 236 H12
0.71261446 0.50367370 0.75944226 T T T # 237 H13
0.81945758 0.53255437 0.75339013 T T T # 238 H14
0.76852747 0.56213550 0.80651115 T T T # 239 H15
0.67651096 0.65534104 0.72080289 T T T # 240 H111