#MD System 2.0 @Title neb0_image08 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 Spin double 0.0 WyckoffPosition int -1 @end @data 14 {} {0.849327537367 0.307808541129 0.062573085567} Si1 1 0.0 1 14 {} {0.849889593104 0.385266227676 0.44439769577} Si2 2 0.0 1 14 {} {0.0992412921232 0.307526679726 0.192583205768} Si3 3 0.0 1 14 {} {0.0992577445214 0.383551175019 0.317577200247} Si4 4 0.0 1 14 {} {0.85898288339 0.542398337903 0.438586877752} Si5 5 0.0 1 14 {} {0.103505593588 0.537754409396 0.305686208842} Si6 6 0.0 1 14 {} {0.847527663829 0.458965577662 0.0663897291399} Si7 7 0.0 1 14 {} {0.845653800609 0.229865255979 0.442217785126} Si8 8 0.0 1 14 {} {0.0993611435762 0.4586700393 0.192409644759} Si9 9 0.0 1 14 {} {0.0954137103706 0.229110184433 0.313693189349} Si10 10 0.0 1 8 {} {0.351443617966 0.595500607801 0.517495339026} O1 11 0.0 1 14 {} {0.349618826462 0.660906564889 0.518154832431} Si11 12 0.0 1 8 {} {0.112806957289 0.589477317961 0.209167441617} O2 13 0.0 1 1 {} {0.0128985851043 0.594086216419 0.149634414706} H1 14 0.0 1 8 {} {0.334618731612 0.178054413548 0.540486249666} O3 15 0.0 1 1 {} {0.933528847756 0.175229156422 0.601123483487} H2 16 0.0 1 8 {} {0.0843084547655 0.177362774042 0.215940531948} O4 17 0.0 1 1 {} {0.183308993964 0.173837925755 0.155825155906} H3 18 0.0 1 14 {} {0.849842403783 0.30810416318 0.564960124174} Si12 19 0.0 1 14 {} {0.849455934643 0.384508640801 0.939094205829} Si13 20 0.0 1 14 {} {0.0995311929873 0.309282210576 0.694536333531} Si14 21 0.0 1 14 {} {0.100304520474 0.387748127247 0.813059085915} Si15 22 0.0 1 14 {} {0.851577292592 0.537260183989 0.950566355935} Si16 23 0.0 1 14 {} {0.102360598839 0.542507917246 0.821919710566} Si17 24 0.0 1 14 {} {0.850953730161 0.464352807811 0.56023933073} Si18 25 0.0 1 14 {} {0.845664198342 0.229130177816 0.942588002496} Si19 26 0.0 1 14 {} {0.100675454222 0.466065579569 0.690780467844} Si20 27 0.0 1 14 {} {0.0958045246162 0.230272673202 0.814888735611} Si21 28 0.0 1 8 {} {0.363573906721 0.589302958085 0.046558234539} O5 29 0.0 1 1 {} {0.263321644521 0.593947067771 0.106499077285} H4 30 0.0 1 8 {} {0.114018398843 0.603403317552 0.779522825214} O6 31 0.0 1 1 {} {0.0923912011822 0.625661046584 0.706347411295} H5 32 0.0 1 8 {} {0.334554425562 0.177607993402 0.0410753156396} O7 33 0.0 1 1 {} {0.933585102258 0.174008555875 0.101062161246} H6 34 0.0 1 8 {} {0.0847152381326 0.179670698324 0.71398269504} O8 35 0.0 1 1 {} {0.184232797793 0.175889963132 0.654228192147} H7 36 0.0 1 14 {} {0.349334151297 0.307819650549 0.0627013875292} Si22 37 0.0 1 14 {} {0.349889217215 0.384917704321 0.443452238423} Si23 38 0.0 1 14 {} {0.599400967584 0.308018202741 0.192557147563} Si24 39 0.0 1 14 {} {0.600475021694 0.383962758201 0.318072704508} Si25 40 0.0 1 14 {} {0.352835188764 0.541929026958 0.435673453334} Si26 41 0.0 1 14 {} {0.606794069672 0.540824641018 0.311021818042} Si27 42 0.0 1 14 {} {0.353363082003 0.458906496047 0.0683998353582} Si28 43 0.0 1 14 {} {0.345331417459 0.229555459192 0.442049302428} Si29 44 0.0 1 14 {} {0.602093584002 0.460628533554 0.198328168565} Si30 45 0.0 1 14 {} {0.595573999172 0.229557045314 0.313895697119} Si31 46 0.0 1 8 {} {0.867746772179 0.591804519165 0.536653877048} O9 47 0.0 1 1 {} {0.949903573011 0.621651680315 0.52987760104} H8 48 0.0 1 8 {} {0.615363839962 0.591238836379 0.211061195221} O10 49 0.0 1 1 {} {0.514863850292 0.595025478321 0.151374326856} H9 50 0.0 1 8 {} {0.83438426238 0.178461480247 0.540901416394} O11 51 0.0 1 1 {} {0.433627739142 0.174697995773 0.600743408502} H10 52 0.0 1 8 {} {0.584768230889 0.177884614689 0.215913434824} O12 53 0.0 1 1 {} {0.6837050676 0.17428321654 0.15575523592} H11 54 0.0 1 14 {} {0.348913545103 0.307825054129 0.564720937358} Si32 55 0.0 1 14 {} {0.350897517408 0.38467836812 0.93976931134} Si33 56 0.0 1 14 {} {0.599263353608 0.308561376605 0.693558689509} Si34 57 0.0 1 14 {} {0.600106909523 0.386639110695 0.812161371575} Si35 58 0.0 1 14 {} {0.352586048595 0.537005516557 0.952656643288} Si36 59 0.0 1 14 {} {0.600425597454 0.540624215474 0.821025074401} Si37 60 0.0 1 14 {} {0.351209028601 0.463953527024 0.561009496559} Si38 61 0.0 1 14 {} {0.345798291086 0.229137494003 0.942731734486} Si39 62 0.0 1 14 {} {0.601336501883 0.464789156786 0.691263225902} Si40 63 0.0 1 14 {} {0.595651470044 0.229870286048 0.814655383483} Si41 64 0.0 1 8 {} {0.861536436189 0.589935979577 0.0437308643059} O13 65 0.0 1 1 {} {0.763272880492 0.594236254421 0.105108810763} H12 66 0.0 1 8 {} {0.596494563992 0.596244799607 0.743668605721} O14 67 0.0 1 14 {} {0.595209356701 0.661593348944 0.744770221919} Si42 68 0.0 1 8 {} {0.834606717393 0.177604746657 0.0409265693724} O15 69 0.0 1 1 {} {0.433568765248 0.174132408708 0.101201486332} H13 70 0.0 1 8 {} {0.584491930492 0.179031558954 0.71439080694} O16 71 0.0 1 1 {} {0.68382155873 0.175546107641 0.654372743116} H14 72 0.0 1 7 {} {0.443545695807 0.687542773398 0.649091175494} N 73 0.0 1 1 {} {0.441160870585 0.751544336663 0.650812979117} H16 74 0.0 1 9 {} {0.791729281748 0.679467581882 0.720425234499} F4 75 0.0 1 9 {} {0.274469078398 0.679654907312 0.385437833541} F5 76 0.0 1 9 {} {0.545824235532 0.680076948733 0.881034153185} F3 77 0.0 1 9 {} {0.13792034516 0.664932669394 0.579723616181} F1 78 0.0 1 9 {} {0.435461652379 0.788887660693 0.660563756546} F2 79 0.0 1 9 {} {0.560030495069 0.675655282675 0.47115804486} F6 80 0.0 1 @end @Columns Cell Constraints string {a b c A B G} Origin int {{0 0 0}} Parameters double {{10.0 10.0 10.0 90.0 90.0 90.0}} PrimitiveData double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} RotationMatrix double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} SpaceGroup string P1 SpaceGroupNumber int 1 ToCartesians double {{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}} ToFractionals double {{{0.10000000000000001 0.0 0.0} {0.0 0.10000000000000001 0.0} {0.0 0.0 0.10000000000000001}}} @end @data {a b c A B G} {0 0 0} {7.6631 25.3262 10.83726 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{7.6631 0 0} {0 25.3262 0} {0 0 10.83726}} {{0.130495491381 0 0} {0 0.0394848022996 0} {0 0 0.0922742464424}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 70 63 0 0 79 11 0 0 45 38 0 0 21 19 0 0 78 73 0 0 3 1 0 0 27 20 0 0 56 54 0 0 37 3 0 0 60 26 0 1 62 24 0 1 17 16 0 0 54 43 0 0 45 43 0 0 27 25 0 0 26 21 0 0 40 10 0 0 44 6 0 1 77 11 0 0 61 36 0 0 38 0 0 0 2 0 0 0 57 19 0 0 13 12 0 0 25 0 0 0 47 46 0 0 75 11 0 0 62 60 0 1 24 1 0 0 18 7 0 0 54 37 0 0 29 28 0 0 57 56 0 0 56 18 0 0 58 28 0 0 42 8 0 0 39 38 0 0 67 66 0 0 66 59 0 0 3 2 0 0 57 55 0 0 19 0 0 0 61 27 0 0 63 25 0 0 49 48 0 0 54 20 0 0 68 33 0 0 44 39 0 0 62 57 0 0 68 25 0 0 8 6 0 0 53 52 0 0 52 45 0 0 45 7 0 0 72 11 0 0 50 7 0 0 72 67 0 0 35 34 0 0 48 41 0 0 11 10 0 0 8 5 0 0 39 1 0 0 61 32 0 0 51 14 0 0 50 15 0 0 21 20 0 0 63 61 0 0 55 42 0 0 38 36 0 0 31 30 0 0 26 24 0 1 65 64 0 0 43 9 0 0 76 67 0 0 18 1 0 0 8 3 0 0 9 7 0 0 55 21 0 0 19 6 0 0 44 42 0 1 36 2 0 0 63 56 0 0 71 70 0 0 16 9 0 0 9 2 0 0 69 32 0 0 39 37 0 0 64 22 0 0 34 27 0 0 20 18 0 0 55 36 0 0 43 14 0 0 46 4 0 0 30 23 0 0 60 37 0 0 12 5 0 0 74 67 0 0 @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data 0 70 63 {0 0 0} 0 1 11 79 {0 0 0} 0 2 45 38 {0 0 0} 0 3 19 21 {1 0 0} 0 4 73 78 {0 0 0} 0 5 3 1 {-1 0 0} 0 6 20 27 {0 0 0} 0 7 56 54 {0 0 0} 0 8 3 37 {0 0 0} 0 9 26 60 {0 0 0} 0 10 62 24 {0 0 0} 0 11 17 16 {0 0 0} 0 12 54 43 {0 0 0} 0 13 43 45 {0 0 0} 0 14 25 27 {1 0 0} 0 15 26 21 {0 0 0} 0 16 40 10 {0 0 0} 0 17 44 6 {0 0 0} 0 18 11 77 {0 0 0} 0 19 61 36 {0 0 1} 0 20 0 38 {0 0 0} 0 21 0 2 {1 0 0} 0 22 57 19 {0 0 0} 0 23 13 12 {0 0 0} 0 24 25 0 {0 0 1} 0 25 47 46 {0 0 0} 0 26 75 11 {0 0 0} 0 27 62 60 {0 0 0} 0 28 1 24 {0 0 0} 0 29 7 18 {0 0 0} 0 30 37 54 {0 0 0} 0 31 28 29 {0 0 0} 0 32 57 56 {0 0 0} 0 33 18 56 {0 0 0} 0 34 28 58 {0 0 -1} 0 35 8 42 {0 0 0} 0 36 38 39 {0 0 0} 0 37 67 66 {0 0 0} 0 38 59 66 {0 0 0} 0 39 3 2 {0 0 0} 0 40 57 55 {0 0 0} 0 41 0 19 {0 0 -1} 0 42 27 61 {0 0 0} 0 43 63 25 {0 0 0} 0 44 48 49 {0 0 0} 0 45 54 20 {0 0 0} 0 46 33 68 {0 0 0} 0 47 39 44 {0 0 0} 0 48 62 57 {0 0 0} 0 49 25 68 {0 0 1} 0 50 6 8 {1 0 0} 0 51 53 52 {0 0 0} 0 52 45 52 {0 0 0} 0 53 45 7 {0 0 0} 0 54 72 11 {0 0 0} 0 55 50 7 {0 0 0} 0 56 72 67 {0 0 0} 0 57 34 35 {0 0 0} 0 58 41 48 {0 0 0} 0 59 10 11 {0 0 0} 0 60 8 5 {0 0 0} 0 61 1 39 {0 0 0} 0 62 61 32 {0 0 1} 0 63 14 51 {0 0 0} 0 64 50 15 {0 0 0} 0 65 20 21 {0 0 0} 0 66 63 61 {0 0 0} 0 67 55 42 {0 0 1} 0 68 38 36 {0 0 0} 0 69 30 31 {0 0 0} 0 70 26 24 {-1 0 0} 0 71 64 65 {0 0 0} 0 72 9 43 {0 0 0} 0 73 76 67 {0 0 0} 0 74 1 18 {0 0 0} 0 75 8 3 {0 0 0} 0 76 7 9 {1 0 0} 0 77 55 21 {0 0 0} 0 78 19 6 {0 0 1} 0 79 44 42 {0 0 0} 0 80 36 2 {0 0 0} 0 81 56 63 {0 0 0} 0 82 70 71 {0 0 0} 0 83 16 9 {0 0 0} 0 84 2 9 {0 0 0} 0 85 69 32 {0 0 0} 0 86 39 37 {0 0 0} 0 87 22 64 {0 0 1} 0 88 27 34 {0 0 0} 0 89 20 18 {-1 0 0} 0 90 55 36 {0 0 1} 0 91 43 14 {0 0 0} 0 92 46 4 {0 0 0} 0 93 23 30 {0 0 0} 0 94 60 37 {0 0 0} 0 95 12 5 {0 0 0} 0 96 67 74 {0 0 0} 0 @end @Columns Subset Color string {{#65d9f0}} Criteria string {{}} DisplayLine int 0 IeqJ int 1 IgtJ int 0 IltJ int 0 Length int 1 Name string {{}} Table string {{}} Type string atom UseColor int 0 @end @data @end