#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 {} {0.849410598624 0.307635563407 0.0628300719457} Si1 1 0.0 1 14 {} {0.849904780672 0.385159089039 0.444523562975} Si2 2 0.0 1 14 {} {0.0994074931142 0.30742636217 0.192842175964} Si3 3 0.0 1 14 {} {0.0997304371959 0.383453021546 0.318080797248} Si4 4 0.0 1 14 {} {0.859282960632 0.541888006243 0.438611031555} Si5 5 0.0 1 14 {} {0.10518717716 0.538321273932 0.306569438293} Si6 6 0.0 1 14 {} {0.850568587384 0.458633734202 0.065954860291} Si7 7 0.0 1 14 {} {0.845566758471 0.229740551791 0.442246987669} Si8 8 0.0 1 14 {} {0.100458319764 0.458881352936 0.194239565064} Si9 9 0.0 1 14 {} {0.0954371020075 0.22899039152 0.313758243564} Si10 10 0.0 1 8 {} {0.362297723654 0.595127505954 0.518309535585} O1 11 0.0 1 14 {} {0.353221568716 0.661893694178 0.515764250403} Si11 12 0.0 1 8 {} {0.112151948152 0.589513661171 0.208955504657} O2 13 0.0 1 1 {} {0.0116677262869 0.593762752123 0.149513207733} H1 14 0.0 1 8 {} {0.334667019055 0.17831458129 0.540640681145} O3 15 0.0 1 1 {} {0.933548462615 0.175115156438 0.601174635627} H2 16 0.0 1 8 {} {0.0843197513948 0.177282471283 0.215952802731} O4 17 0.0 1 1 {} {0.18329277036 0.173723312477 0.155795849502} H3 18 0.0 1 14 {} {0.84970865284 0.307976495492 0.564958754593} Si12 19 0.0 1 14 {} {0.850028819996 0.384196277255 0.938736265323} Si13 20 0.0 1 14 {} {0.0997785758067 0.309210032918 0.694228120077} Si14 21 0.0 1 14 {} {0.100420825545 0.387792675106 0.812328030322} Si15 22 0.0 1 14 {} {0.850833818739 0.537347073777 0.951062099117} Si16 23 0.0 1 14 {} {0.10194207736 0.542954647152 0.822904335891} Si17 24 0.0 1 14 {} {0.850888470367 0.464102140125 0.561531917147} Si18 25 0.0 1 14 {} {0.845611725011 0.229003561619 0.942654223872} Si19 26 0.0 1 14 {} {0.10058466522 0.466770321957 0.691742619213} Si20 27 0.0 1 14 {} {0.0958157318811 0.230159503329 0.81484522252} Si21 28 0.0 1 8 {} {0.364206833353 0.588866664551 0.0471259398459} O5 29 0.0 1 1 {} {0.263548238225 0.594154643109 0.106249021145} H4 30 0.0 1 8 {} {0.123512450233 0.603552377592 0.778172812456} O6 31 0.0 1 1 {} {0.0909523331147 0.624042184553 0.703804393779} H5 32 0.0 1 8 {} {0.334480629637 0.177476212976 0.0410844619238} O7 33 0.0 1 1 {} {0.933547492571 0.173857597673 0.101040438661} H6 34 0.0 1 8 {} {0.0846291885608 0.179515861889 0.714061684161} O8 35 0.0 1 1 {} {0.184147070518 0.175741106508 0.654267469523} H7 36 0.0 1 14 {} {0.349184365498 0.307642498165 0.0627705917581} Si22 37 0.0 1 14 {} {0.349396285733 0.386143991444 0.444841990553} Si23 38 0.0 1 14 {} {0.599157596166 0.307787476729 0.192790004708} Si24 39 0.0 1 14 {} {0.599695727627 0.383790391701 0.318539225209} Si25 40 0.0 1 14 {} {0.357074598185 0.542277692959 0.434203395271} Si26 41 0.0 1 14 {} {0.609494436496 0.539549982086 0.308226956383} Si27 42 0.0 1 14 {} {0.352015510776 0.458431217383 0.0678837853137} Si28 43 0.0 1 14 {} {0.345416646995 0.229777568126 0.442082371904} Si29 44 0.0 1 14 {} {0.60289913524 0.459601224949 0.195610278433} Si30 45 0.0 1 14 {} {0.595525599943 0.229334540798 0.313867305282} Si31 46 0.0 1 8 {} {0.869406623582 0.591420428514 0.535804600062} O9 47 0.0 1 1 {} {0.943965844932 0.622918156555 0.523037297919} H8 48 0.0 1 8 {} {0.615928354512 0.590954731042 0.211090266283} O10 49 0.0 1 1 {} {0.513976227182 0.595011139165 0.152685299382} H9 50 0.0 1 8 {} {0.83438760877 0.178344921574 0.540931734073} O11 51 0.0 1 1 {} {0.433782988844 0.17473444479 0.60076739352} H10 52 0.0 1 8 {} {0.584661202819 0.177700209775 0.215832886359} O12 53 0.0 1 1 {} {0.683665276234 0.174121202898 0.15569840475} H11 54 0.0 1 14 {} {0.349086809805 0.308391339208 0.564198622386} Si32 55 0.0 1 14 {} {0.350119050361 0.384301397063 0.939509390462} Si33 56 0.0 1 14 {} {0.599078831157 0.308439812464 0.693581492559} Si34 57 0.0 1 14 {} {0.599684144654 0.386501076416 0.81242626543} Si35 58 0.0 1 14 {} {0.351613831191 0.536673499508 0.953117949975} Si36 59 0.0 1 14 {} {0.599387944762 0.540659987506 0.8214884701} Si37 60 0.0 1 14 {} {0.350432177758 0.465313529862 0.561127610475} Si38 61 0.0 1 14 {} {0.345778929694 0.228993467842 0.942781258905} Si39 62 0.0 1 14 {} {0.600212935687 0.464802106526 0.691530498356} Si40 63 0.0 1 14 {} {0.595562939012 0.229713846505 0.814613421062} Si41 64 0.0 1 8 {} {0.860937256827 0.589745671055 0.0447340869784} O13 65 0.0 1 1 {} {0.76154624961 0.594661615183 0.105328608286} H12 66 0.0 1 8 {} {0.596025291281 0.596343965847 0.746088289682} O14 67 0.0 1 14 {} {0.589092131731 0.661805109882 0.748110551895} Si42 68 0.0 1 8 {} {0.834558755453 0.177467209354 0.0409077820126} O15 69 0.0 1 1 {} {0.433492900658 0.173970412254 0.101234833766} H13 70 0.0 1 8 {} {0.584564252943 0.178858375779 0.714457432422} O16 71 0.0 1 1 {} {0.683874964758 0.175347844356 0.654401650581} H14 72 0.0 1 7 {} {0.436540047022 0.68852798803 0.652959935825} N 73 0.0 1 1 {} {0.433951357385 0.753333810533 0.660078154668} H16 74 0.0 1 9 {} {0.783977190822 0.679864827334 0.717336860397} F4 75 0.0 1 9 {} {0.275424976039 0.681129459849 0.384141654998} F5 76 0.0 1 9 {} {0.55229833348 0.678406602541 0.888103993904} F3 77 0.0 1 9 {} {0.14068303662 0.663194948985 0.574656685122} F1 78 0.0 1 9 {} {0.436225858425 0.79156863047 0.658496634704} F2 79 0.0 1 9 {} {0.557499710346 0.675294099005 0.465614423811} 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