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
0.00323046 0.16613254 0.58921752 T T T # 1 Ti1
0.17070934 0.33243818 0.27170860 F F F # 2 Ti2
0.00590018 0.16389966 0.45882202 T T T # 3 Ti3
0.17070934 0.33243818 0.39049069 F F F # 4 Ti4
0.00404267 0.16577151 0.33109965 F F F # 5 Ti5
0.17395430 0.33087512 0.50622096 T T T # 6 Ti6
0.00404267 0.16577151 0.21231756 F F F # 7 Ti7
0.17127757 0.33244001 0.62208501 T T T # 8 Ti8
0.00466158 0.49800516 0.58834910 T T T # 9 Ti9
0.17070934 0.66577151 0.27170860 F F F # 10 Ti10
0.00656868 0.49682111 0.45883708 T T T # 11 Ti11
0.17070934 0.66577151 0.39049069 F F F # 12 Ti12
0.00404267 0.49910485 0.33109965 F F F # 13 Ti13
0.17304112 0.66322193 0.50626210 T T T # 14 Ti14
0.00404267 0.49910485 0.21231756 F F F # 15 Ti15
0.17047466 0.66576251 0.62218152 T T T # 16 Ti16
0.00363763 0.83215479 0.58879466 T T T # 17 Ti17
0.17070934 0.99910485 0.27170860 F F F # 18 Ti18
0.00584538 0.83010150 0.45900511 T T T # 19 Ti19
0.17070934 0.99910485 0.39049069 F F F # 20 Ti20
0.00404267 0.83243818 0.33109965 F F F # 21 Ti21
0.17153196 0.99797935 0.50597724 T T T # 22 Ti22
0.00404267 0.83243818 0.21231756 F F F # 23 Ti23
0.16958405 0.99987813 0.62211996 T T T # 24 Ti24
0.33710226 0.16543950 0.58857806 T T T # 25 Ti25
0.50404267 0.33243818 0.27170860 F F F # 26 Ti26
0.33975692 0.16369863 0.45884041 T T T # 27 Ti27
0.50404267 0.33243818 0.39049069 F F F # 28 Ti28
0.33737600 0.16577151 0.33109965 F F F # 29 Ti29
0.50618976 0.33022755 0.50621922 T T T # 30 Ti30
0.33737600 0.16577151 0.21231756 F F F # 31 Ti31
0.50428625 0.33161874 0.62207862 T T T # 32 Ti32
0.33988010 0.50108631 0.58998240 T T T # 33 Ti33
0.50404267 0.66577151 0.27170860 F F F # 34 Ti34
0.34102148 0.49816393 0.45945873 T T T # 35 Ti35
0.50404267 0.66577151 0.39049069 F F F # 36 Ti36
0.33737600 0.49910485 0.33109965 F F F # 37 Ti37
0.50660429 0.66384716 0.50983471 T T T # 38 Ti38
0.33737600 0.49910485 0.21231756 F F F # 39 Ti39
0.49995385 0.66750189 0.63112013 T T T # 40 Ti40
0.33273551 0.83686145 0.58570431 T T T # 41 Ti41
0.50404267 0.99910485 0.27170860 F F F # 42 Ti42
0.33998980 0.82971737 0.45826665 T T T # 43 Ti43
0.50404267 0.99910485 0.39049069 F F F # 44 Ti44
0.33737600 0.83243818 0.33109965 F F F # 45 Ti45
0.50651057 0.99654478 0.50623251 T T T # 46 Ti46
0.33737600 0.83243818 0.21231756 F F F # 47 Ti47
0.50351601 0.99888377 0.62218848 T T T # 48 Ti48
0.67097802 0.16507868 0.58867841 T T T # 49 Ti49
0.83737600 0.33243818 0.27170860 F F F # 50 Ti50
0.67280880 0.16329993 0.45890863 T T T # 51 Ti51
0.83737600 0.33243818 0.39049069 F F F # 52 Ti52
0.67070934 0.16577151 0.33109965 F F F # 53 Ti53
0.83984028 0.32981833 0.50602502 T T T # 54 Ti54
0.67070934 0.16577151 0.21231756 F F F # 55 Ti55
0.83691961 0.33235970 0.62211247 T T T # 56 Ti56
0.67288817 0.49691648 0.58632533 T T T # 57 Ti57
0.83737600 0.66577151 0.27170860 F F F # 58 Ti58
0.67266942 0.49741702 0.45822147 T T T # 59 Ti59
0.83737600 0.66577151 0.39049069 F F F # 60 Ti60
0.67070934 0.49910485 0.33109965 F F F # 61 Ti61
0.83985908 0.66361400 0.50656922 T T T # 62 Ti62
0.67070934 0.49910485 0.21231756 F F F # 63 Ti63
0.83744012 0.66456685 0.62287024 T T T # 64 Ti64
0.66724505 0.82931163 0.58965367 T T T # 65 Ti65
0.83737600 0.99910485 0.27170860 F F F # 66 Ti66
0.67207284 0.82886520 0.45938590 T T T # 67 Ti67
0.83737600 0.99910485 0.39049069 F F F # 68 Ti68
0.67070934 0.83243818 0.33109965 F F F # 69 Ti69
0.83873451 0.99613727 0.50630542 T T T # 70 Ti70
0.67070934 0.83243818 0.21231756 F F F # 71 Ti71
0.83649462 0.99801925 0.62204319 T T T # 72 Ti72
0.10398994 0.26464157 0.57343096 T T T # 73 O1
0.26474267 0.23840485 0.27170860 F F F # 74 O2
0.07667600 0.09313818 0.27170860 F F F # 75 O3
0.23747728 0.06627036 0.57285488 T T T # 76 O4
0.10523906 0.26605392 0.45315567 T T T # 77 O5
0.26474267 0.23840485 0.39049069 F F F # 78 O6
0.07667600 0.09313818 0.39049069 F F F # 79 O7
0.23680657 0.06489150 0.45285454 T T T # 80 O8
0.09807600 0.25980485 0.33109965 F F F # 81 O9
0.27252739 0.23091620 0.51378457 T T T # 82 O10
0.07032473 0.09919623 0.51334118 T T T # 83 O11
0.24334267 0.07173818 0.33109965 F F F # 84 O12
0.09807600 0.25980485 0.21231756 F F F # 85 O13
0.26595953 0.23610572 0.63751809 T T T # 86 O14
0.07465379 0.09481442 0.63812010 T T T # 87 O15
0.24334267 0.07173818 0.21231756 F F F # 88 O16
0.10395415 0.59792391 0.57318069 T T T # 89 O17
0.26474267 0.57173818 0.27170860 F F F # 90 O18
0.07667600 0.42647151 0.27170860 F F F # 91 O19
0.23827729 0.39903471 0.57329800 T T T # 92 O20
0.10523343 0.59902344 0.45278018 T T T # 93 O21
0.26474267 0.57173818 0.39049069 F F F # 94 O22
0.07667600 0.42647151 0.39049069 F F F # 95 O23
0.23744367 0.39827602 0.45296171 T T T # 96 O24
0.09807600 0.59313818 0.33109965 F F F # 97 O25
0.27239555 0.56437555 0.51401922 T T T # 98 O26
0.07069364 0.43269997 0.51369313 T T T # 99 O27
0.24334267 0.40507151 0.33109965 F F F # 100 O28
0.09807600 0.59313818 0.21231756 F F F # 101 O29
0.26434697 0.57020719 0.63825841 T T T # 102 O30
0.07548599 0.42675794 0.63759978 T T T # 103 O31
0.24334267 0.40507151 0.21231756 F F F # 104 O32
0.10314476 0.93196879 0.57296104 T T T # 105 O33
0.26474267 0.90507151 0.27170860 F F F # 106 O34
0.07667600 0.75980485 0.27170860 F F F # 107 O35
0.23524977 0.73312462 0.57242934 T T T # 108 O36
0.10467453 0.93284942 0.45280380 T T T # 109 O37
0.26474267 0.90507151 0.39049069 F F F # 110 O38
0.07667600 0.75980485 0.39049069 F F F # 111 O39
0.23701335 0.73131216 0.45292616 T T T # 112 O40
0.09807600 0.92647151 0.33109965 F F F # 113 O41
0.27164799 0.89788665 0.51284493 T T T # 114 O42
0.06988571 0.76562575 0.51335135 T T T # 115 O43
0.24334267 0.73840485 0.33109965 F F F # 116 O44
0.09807600 0.92647151 0.21231756 F F F # 117 O45
0.26334379 0.90619828 0.63789789 T T T # 118 O46
0.07517964 0.76074895 0.63781008 T T T # 119 O47
0.24334267 0.73840485 0.21231756 F F F # 120 O48
0.43695518 0.26427339 0.57315658 T T T # 121 O49
0.59807600 0.23840485 0.27170860 F F F # 122 O50
0.41000934 0.09313818 0.27170860 F F F # 123 O51
0.57157833 0.06568178 0.57327573 T T T # 124 O52
0.43821727 0.26597130 0.45277103 T T T # 125 O53
0.59807600 0.23840485 0.39049069 F F F # 126 O54
0.41000934 0.09313818 0.39049069 F F F # 127 O55
0.57071312 0.06442957 0.45278215 T T T # 128 O56
0.43140934 0.25980485 0.33109965 F F F # 129 O57
0.60532807 0.23019703 0.51333167 T T T # 130 O58
0.40394779 0.09965656 0.51325040 T T T # 131 O59
0.57667600 0.07173818 0.33109965 F F F # 132 O60
0.43140934 0.25980485 0.21231756 F F F # 133 O61
0.59926232 0.23565589 0.63767144 T T T # 134 O62
0.40851760 0.09427764 0.63764804 T T T # 135 O63
0.57667600 0.07173818 0.21231756 F F F # 136 O64
0.43607843 0.59745357 0.57691932 T T T # 137 O65
0.59807600 0.57173818 0.27170860 F F F # 138 O66
0.41000934 0.42647151 0.27170860 F F F # 139 O67
0.57210251 0.39588601 0.57242574 T T T # 140 O68
0.43929532 0.59989658 0.45452578 T T T # 141 O69
0.59807600 0.57173818 0.39049069 F F F # 142 O70
0.41000934 0.42647151 0.39049069 F F F # 143 O71
0.57033079 0.39803944 0.45290287 T T T # 144 O72
0.43140934 0.59313818 0.33109965 F F F # 145 O73
0.60611836 0.56356893 0.51396497 T T T # 146 O74
0.40427755 0.43265255 0.51394482 T T T # 147 O75
0.57667600 0.40507151 0.33109965 F F F # 148 O76
0.43140934 0.59313818 0.21231756 F F F # 149 O77
0.60416434 0.56604859 0.63145303 T T T # 150 O78
0.40918227 0.42530841 0.63840856 T T T # 151 O79
0.57667600 0.40507151 0.21231756 F F F # 152 O80
0.43629966 0.93436761 0.57223573 T T T # 153 O81
0.59807600 0.90507151 0.27170860 F F F # 154 O82
0.41000934 0.75980485 0.27170860 F F F # 155 O83
0.57154669 0.73280439 0.57695998 T T T # 156 O84
0.43837570 0.93271079 0.45287002 T T T # 157 O85
0.59807600 0.90507151 0.39049069 F F F # 158 O86
0.41000934 0.75980485 0.39049069 F F F # 159 O87
0.56997756 0.73053851 0.45444179 T T T # 160 O88
0.43140934 0.92647151 0.33109965 F F F # 161 O89
0.60514141 0.89711495 0.51394583 T T T # 162 O90
0.40337274 0.76630298 0.51330979 T T T # 163 O91
0.57667600 0.73840485 0.33109965 F F F # 164 O92
0.43140934 0.92647151 0.21231756 F F F # 165 O93
0.59854259 0.90493837 0.63843702 T T T # 166 O94
0.40369790 0.76633431 0.63141591 T T T # 167 O95
0.57667600 0.73840485 0.21231756 F F F # 168 O96
0.77029234 0.26448137 0.57287804 T T T # 169 O97
0.93140934 0.23840485 0.27170860 F F F # 170 O98
0.74334267 0.09313818 0.27170860 F F F # 171 O99
0.90459787 0.06545990 0.57351462 T T T # 172 O100
0.77231299 0.26524250 0.45276307 T T T # 173 O101
0.93140934 0.23840485 0.39049069 F F F # 174 O102
0.74334267 0.09313818 0.39049069 F F F # 175 O103
0.90366460 0.06449462 0.45316369 T T T # 176 O104
0.76474267 0.25980485 0.33109965 F F F # 177 O105
0.93908329 0.23046181 0.51396115 T T T # 178 O106
0.73683477 0.09903039 0.51374676 T T T # 179 O107
0.91000934 0.07173818 0.33109965 F F F # 180 O108
0.76474267 0.25980485 0.21231756 F F F # 181 O109
0.93291261 0.23636385 0.63812972 T T T # 182 O110
0.74219965 0.09406912 0.63769618 T T T # 183 O111
0.91000934 0.07173818 0.21231756 F F F # 184 O112
0.77379108 0.59717827 0.57261666 T T T # 185 O113
0.93140934 0.57173818 0.27170860 F F F # 186 O114
0.74334267 0.42647151 0.27170860 F F F # 187 O115
0.90486953 0.39885091 0.57280994 T T T # 188 O116
0.77188814 0.59951909 0.45306548 T T T # 189 O117
0.93140934 0.57173818 0.39049069 F F F # 190 O118
0.74334267 0.42647151 0.39049069 F F F # 191 O119
0.90442319 0.39739916 0.45281036 T T T # 192 O120
0.76474267 0.59313818 0.33109965 F F F # 193 O121
0.93954946 0.56416490 0.51334007 T T T # 194 O122
0.73791930 0.43172583 0.51194797 T T T # 195 O123
0.91000934 0.40507151 0.33109965 F F F # 196 O124
0.76474267 0.59313818 0.21231756 F F F # 197 O125
0.93431458 0.56963200 0.63712336 T T T # 198 O126
0.74460837 0.42483986 0.63858608 T T T # 199 O127
0.91000934 0.40507151 0.21231756 F F F # 200 O128
0.77012624 0.93137547 0.57320072 T T T # 201 O129
0.93140934 0.90507151 0.27170860 F F F # 202 O130
0.74334267 0.75980485 0.27170860 F F F # 203 O131
0.90510472 0.73257843 0.57375995 T T T # 204 O132
0.77147030 0.93232370 0.45298326 T T T # 205 O133
0.93140934 0.90507151 0.39049069 F F F # 206 O134
0.74334267 0.75980485 0.39049069 F F F # 207 O135
0.90371168 0.73152799 0.45290168 T T T # 208 O136
0.76474267 0.92647151 0.33109965 F F F # 209 O137
0.93864126 0.89718208 0.51390011 T T T # 210 O138
0.73696288 0.76527706 0.51388649 T T T # 211 O139
0.91000934 0.73840485 0.33109965 F F F # 212 O140
0.76474267 0.92647151 0.21231756 F F F # 213 O141
0.93295216 0.90354731 0.63775799 T T T # 214 O142
0.74334719 0.76066540 0.63784842 T T T # 215 O143
0.91000934 0.73840485 0.21231756 F F F # 216 O144
0.49950009 0.65899911 0.70579517 T T T # 217 O885
0.47240595 0.66512049 0.83235902 T T T # 218 Si
0.63615679 0.64774990 0.80146032 T T T # 219 N
0.39311252 0.56276119 0.81685320 T T T # 220 C1
0.49635519 0.66128521 0.90428344 T T T # 221 C2
0.41987403 0.78258364 0.81222815 T T T # 222 C3
0.69289577 0.72801904 0.79147622 T T T # 223 C4
0.67885725 0.55630991 0.80430100 T T T # 224 C5
0.37821746 0.56188863 0.77454404 T T T # 225 H1
0.42138024 0.49227290 0.82904680 T T T # 226 H2
0.32639036 0.57149564 0.83765250 T T T # 227 H3
0.52849939 0.59325830 0.91657485 T T T # 228 H4
0.54298210 0.72045987 0.91501800 T T T # 229 H5
0.43177620 0.66787660 0.92650386 T T T # 230 H6
0.35229577 0.78770414 0.82996723 T T T # 231 H7
0.45987485 0.84433072 0.82384523 T T T # 232 H8
0.41151766 0.78739988 0.77030662 T T T # 233 H9
0.74449134 0.73539334 0.81821651 T T T # 234 H10
0.72270863 0.71751555 0.75599659 T T T # 235 H11
0.65821457 0.79582753 0.79111712 T T T # 236 H12
0.63309768 0.49796837 0.81188403 T T T # 237 H13
0.71140529 0.53767961 0.76982226 T T T # 238 H14
0.72893175 0.55905265 0.83245633 T T T # 239 H15
0.57952836 0.61906582 0.71817519 T T T # 240 H111