#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 {} {0.849329390755 0.307660075909 0.0628733758334} Si1 1 0.0 1 14 {} {0.84998036099 0.385142849881 0.444427158116} Si2 2 0.0 1 14 {} {0.0992326548967 0.307438394608 0.192695684167} Si3 3 0.0 1 14 {} {0.0993240852197 0.383434170336 0.31781913607} Si4 4 0.0 1 14 {} {0.858271295958 0.542058276954 0.438512059629} Si5 5 0.0 1 14 {} {0.105760138247 0.538353434464 0.307338287075} Si6 6 0.0 1 14 {} {0.849827269885 0.458625366525 0.066113411268} Si7 7 0.0 1 14 {} {0.845565200892 0.229724086642 0.442153292771} Si8 8 0.0 1 14 {} {0.100296424487 0.458766495867 0.193651803056} Si9 9 0.0 1 14 {} {0.095362115898 0.2289971719 0.313760103328} Si10 10 0.0 1 8 {} {0.367033778964 0.595416839765 0.515674401303} O1 11 0.0 1 14 {} {0.347733878729 0.663664349702 0.517467746453} Si11 12 0.0 1 8 {} {0.11225810275 0.589356817878 0.209126521082} O2 13 0.0 1 1 {} {0.0119982853561 0.593888329147 0.149570696518} H1 14 0.0 1 8 {} {0.334648387351 0.17818543763 0.540614641712} O3 15 0.0 1 1 {} {0.933532249668 0.175139722711 0.601188946885} H2 16 0.0 1 8 {} {0.0843032887091 0.177296419095 0.215945162576} O4 17 0.0 1 1 {} {0.183264406237 0.173737437038 0.155804108272} H3 18 0.0 1 14 {} {0.84969145274 0.307988715932 0.565013372213} Si12 19 0.0 1 14 {} {0.849704420709 0.384205404052 0.938904342314} Si13 20 0.0 1 14 {} {0.0995851879262 0.309132925857 0.694178073606} Si14 21 0.0 1 14 {} {0.100317901891 0.38768461257 0.812841699596} Si15 22 0.0 1 14 {} {0.851038945999 0.53720978941 0.950769437926} Si16 23 0.0 1 14 {} {0.101660491478 0.543310254443 0.822239854637} Si17 24 0.0 1 14 {} {0.85083166153 0.464033746887 0.561321853779} Si18 25 0.0 1 14 {} {0.845570256818 0.229004900454 0.942602404692} Si19 26 0.0 1 14 {} {0.100412950338 0.466577816527 0.691587758645} Si20 27 0.0 1 14 {} {0.0957239696369 0.230093627932 0.814980411332} Si21 28 0.0 1 8 {} {0.36422626758 0.58889920896 0.046811554964} O5 29 0.0 1 1 {} {0.263723298439 0.594027658234 0.106099487094} H4 30 0.0 1 8 {} {0.121041359358 0.603326082591 0.780343238798} O6 31 0.0 1 1 {} {0.0902791144935 0.624299114531 0.703483897775} H5 32 0.0 1 8 {} {0.334489708815 0.177512304742 0.0410723694138} O7 33 0.0 1 1 {} {0.933516780877 0.173881306881 0.101048245956} H6 34 0.0 1 8 {} {0.084605191334 0.179521441453 0.71403025535} O8 35 0.0 1 1 {} {0.184145323758 0.175736230164 0.654258804923} H7 36 0.0 1 14 {} {0.349213981888 0.307718924857 0.0628922106585} Si22 37 0.0 1 14 {} {0.349364791099 0.385990431214 0.444281829573} Si23 38 0.0 1 14 {} {0.599279766009 0.307792871648 0.192578562866} Si24 39 0.0 1 14 {} {0.600006987887 0.383682117299 0.318444900567} Si25 40 0.0 1 14 {} {0.3569608475 0.541821137461 0.432920020717} Si26 41 0.0 1 14 {} {0.607650105932 0.539616997323 0.30887205318} Si27 42 0.0 1 14 {} {0.352090553102 0.458579879418 0.0680092535181} Si28 43 0.0 1 14 {} {0.345394283217 0.229604685277 0.441931675476} Si29 44 0.0 1 14 {} {0.602273662861 0.459616161698 0.196040674181} Si30 45 0.0 1 14 {} {0.595551071165 0.229382589426 0.313868009254} Si31 46 0.0 1 8 {} {0.868441461506 0.59166838556 0.535307445266} O9 47 0.0 1 1 {} {0.945516724855 0.622430390033 0.524415405966} H8 48 0.0 1 8 {} {0.615092928255 0.591083200707 0.211990743388} O10 49 0.0 1 1 {} {0.514117559833 0.594862543275 0.152711657619} H9 50 0.0 1 8 {} {0.834385788495 0.178373818102 0.54093580693} O11 51 0.0 1 1 {} {0.433734945549 0.174690415767 0.600796342907} H10 52 0.0 1 8 {} {0.584694284213 0.177754693731 0.215869945949} O12 53 0.0 1 1 {} {0.683634326027 0.17415210313 0.155730465699} H11 54 0.0 1 14 {} {0.349044581265 0.308200720549 0.564538090542} Si32 55 0.0 1 14 {} {0.350352521525 0.384455877053 0.939591993189} Si33 56 0.0 1 14 {} {0.599214437749 0.308447143741 0.693556457562} Si34 57 0.0 1 14 {} {0.599763612496 0.386435163907 0.81265002368} Si35 58 0.0 1 14 {} {0.351329392467 0.536843595705 0.952548794926} Si36 59 0.0 1 14 {} {0.599761683405 0.54076223424 0.821295743167} Si37 60 0.0 1 14 {} {0.350741914275 0.46571191206 0.560801368258} Si38 61 0.0 1 14 {} {0.345772276421 0.228987020047 0.942711139272} Si39 62 0.0 1 14 {} {0.600491432006 0.464714649892 0.691479161006} Si40 63 0.0 1 14 {} {0.595580236843 0.22972044733 0.814703023665} Si41 64 0.0 1 8 {} {0.861093787045 0.58968166506 0.0444117712516} O13 65 0.0 1 1 {} {0.762020354192 0.594583837744 0.105156140461} H12 66 0.0 1 8 {} {0.597827270771 0.596199587993 0.746095245676} O14 67 0.0 1 14 {} {0.590372025784 0.661167574303 0.748176187993} Si42 68 0.0 1 8 {} {0.834576509758 0.177515680218 0.0409056219557} O15 69 0.0 1 1 {} {0.433455886679 0.17400008346 0.101227833404} H13 70 0.0 1 8 {} {0.584504325811 0.1789037318 0.714449403693} O16 71 0.0 1 1 {} {0.683810470893 0.175381708777 0.654403910522} H14 72 0.0 1 7 {} {0.436094143737 0.688821596125 0.655438154505} N 73 0.0 1 1 {} {0.436128374049 0.752425207709 0.65854294145} H16 74 0.0 1 9 {} {0.785575197622 0.679387240269 0.718257647792} F4 75 0.0 1 9 {} {0.273529157003 0.680270057733 0.381414992776} F5 76 0.0 1 9 {} {0.552105250224 0.67889378925 0.887315787035} F3 77 0.0 1 9 {} {0.142737658787 0.664213881833 0.575151333208} F1 78 0.0 1 9 {} {0.436036907585 0.790947960585 0.658469589706} F2 79 0.0 1 9 {} {0.558433665603 0.675609771608 0.467038405142} 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