#MD System 2.0 @Title neb0_image09 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Freeze int 0 Name string {{}} Site int 1 Spin double 0.0 WyckoffPosition int -1 @end @data 14 {} {0.121791401861 0.131523804872 0.386294002189} 7 Si1 1 0.0 1 14 {} {0.367460551861 0.125422354872 0.307429742189} 7 Si2 2 0.0 1 14 {} {0.303546988884 0.0899567596467 0.60945824629} 0 Si3 3 0.0 1 14 {} {0.0941706118607 0.398967274872 0.149954492189} 7 Si4 4 0.0 1 14 {} {0.0871664518607 0.383421374872 0.462845392189} 7 Si5 5 0.0 1 14 {} {0.345209871861 0.372309274872 0.228907682189} 7 Si6 6 0.0 1 14 {} {0.340568938633 0.351053129111 0.537217740649} 0 Si7 7 0.0 1 8 {} {0.0652132318607 0.0186806148719 0.103631632189} 7 O1 8 0.0 1 8 {} {0.0751278018607 0.0321993348719 0.438767932189} 7 O2 9 0.0 1 8 {} {0.295099421861 0.244220574872 0.268693972189} 7 O3 10 0.0 1 8 {} {0.306168159492 0.189069494592 0.55287434958} 0 O4 11 0.0 1 8 {} {0.148043121861 0.272139854872 0.107880822189} 7 O5 12 0.0 1 8 {} {0.149812861861 0.280033464872 0.415268972189} 7 O6 13 0.0 1 8 {} {0.411799441861 0.493039984872 0.268171392189} 7 O7 14 0.0 1 8 {} {0.352631144458 0.442676426107 0.595306786905} 0 O8 15 0.0 1 8 {} {0.458811191861 0.312386694872 0.184371302189} 7 O9 16 0.0 1 8 {} {0.442070411861 0.378397304872 0.480940592189} 7 O10 17 0.0 1 8 {} {0.216344451861 0.438970624872 0.194686302189} 7 O11 18 0.0 1 8 {} {0.191323211275 0.406088537082 0.514571879838} 0 O12 19 0.0 1 8 {} {0.260968991861 0.0737210648719 0.356579722189} 7 O13 20 0.0 1 8 {} {0.150275356429 0.075204089213 0.636834221904} 0 O14 21 0.0 1 8 {} {0.00764254186074 0.148162024872 0.336411782189} 7 O15 22 0.0 1 8 {} {0.895695073586 0.232633545589 0.657949244748} 0 O16 23 0.0 1 14 {} {0.122596711861 0.632648264872 0.382252132189} 7 Si8 24 0.0 1 14 {} {0.373353391861 0.625718254872 0.306940252189} 7 Si9 25 0.0 1 14 {} {0.315502301892 0.598792085624 0.613497388438} 0 Si10 26 0.0 1 14 {} {0.107257271861 0.897481954872 0.146861502189} 7 Si11 27 0.0 1 14 {} {0.0820285618607 0.877453484872 0.463842132189} 7 Si12 28 0.0 1 14 {} {0.353361301861 0.873213004872 0.228773022189} 7 Si13 29 0.0 1 14 {} {0.338792812253 0.842183157982 0.538527476054} 0 Si14 30 0.0 1 8 {} {0.0444176118607 0.523799194872 0.109994842189} 7 O17 31 0.0 1 8 {} {0.0645290218607 0.530555144872 0.431552432189} 7 O18 32 0.0 1 8 {} {0.301952301861 0.745619764872 0.268517512189} 7 O19 33 0.0 1 8 {} {0.371032439415 0.688187914934 0.55922393218} 0 O20 34 0.0 1 8 {} {0.159431291861 0.766081164872 0.106939362189} 7 O21 35 0.0 1 8 {} {0.137674281861 0.781753454872 0.412410502189} 7 O22 36 0.0 1 8 {} {0.415383831861 0.995711294872 0.268585072189} 7 O23 37 0.0 1 8 {} {0.37206268832 0.944041096682 0.591910874989} 0 O24 38 0.0 1 8 {} {0.470228911861 0.812866574872 0.185878902189} 7 O25 39 0.0 1 8 {} {0.433470121861 0.873705004872 0.483923302189} 7 O26 40 0.0 1 8 {} {0.227150111861 0.938446334872 0.192456962189} 7 O27 41 0.0 1 8 {} {0.180015559051 0.869603693781 0.519994048567} 0 O28 42 0.0 1 8 {} {0.270712821861 0.580833804872 0.358707202189} 7 O29 43 0.0 1 8 {} {0.0223591718607 0.645771594872 0.327271122189} 7 O30 44 0.0 1 8 {} {0.933108936574 0.546318300289 0.677317475697} 0 O31 45 0.0 1 14 {} {0.618536691861 0.174659214872 0.387007932189} 7 Si15 46 0.0 1 14 {} {0.863207531861 0.100372134872 0.308479372189} 7 Si16 47 0.0 1 14 {} {0.811395329892 0.123324440462 0.617208114847} 0 Si17 48 0.0 1 14 {} {0.590407191861 0.370469584872 0.148816552189} 7 Si18 49 0.0 1 14 {} {0.593760251861 0.426149004872 0.461263752189} 7 Si19 50 0.0 1 14 {} {0.840642901861 0.349017564872 0.229765382189} 7 Si20 51 0.0 1 14 {} {0.831577287378 0.354213149222 0.536258930715} 0 Si21 52 0.0 1 8 {} {0.551602381861 0.991279294872 0.104800322189} 7 O32 53 0.0 1 8 {} {0.569179701861 0.0837265148719 0.441786862189} 7 O33 54 0.0 1 8 {} {0.811067751861 0.198382464872 0.256775862189} 7 O34 55 0.0 1 8 {} {0.780303126869 0.201096998659 0.556253002234} 0 O35 56 0.0 1 8 {} {0.644129351861 0.240292224872 0.108563442189} 7 O36 57 0.0 1 8 {} {0.652446551861 0.328159294872 0.410498122189} 7 O37 58 0.0 1 8 {} {0.872714571861 0.448356444872 0.283845142189} 7 O38 59 0.0 1 8 {} {0.914278869194 0.430882847587 0.586342482429} 0 O39 60 0.0 1 8 {} {0.968753681861 0.332790074872 0.186181922189} 7 O40 61 0.0 1 8 {} {0.940093101861 0.329963504872 0.487412292189} 7 O41 62 0.0 1 8 {} {0.709902641861 0.408779744872 0.194836022189} 7 O42 63 0.0 1 8 {} {0.69967176818 0.437563493324 0.51473777953} 0 O43 64 0.0 1 8 {} {0.752439571861 0.100971924872 0.360115752189} 7 O44 65 0.0 1 8 {} {0.666829338087 0.099660296379 0.652416230227} 0 O45 66 0.0 1 8 {} {0.501895551861 0.189427204872 0.338209492189} 7 O46 67 0.0 1 8 {} {0.393343852985 0.149221341448 0.663408978534} 0 O47 68 0.0 1 14 {} {0.625915391861 0.680285044872 0.385423932189} 7 Si22 69 0.0 1 14 {} {0.869604981861 0.606088914872 0.305353432189} 7 Si23 70 0.0 1 14 {} {0.814705765615 0.658800343811 0.653678287006} 0 Si24 71 0.0 1 14 {} {0.597713781861 0.870995194872 0.147878942189} 7 Si25 72 0.0 1 14 {} {0.583780441861 0.926341214872 0.463504222189} 7 Si26 73 0.0 1 14 {} {0.850740491861 0.851769184872 0.226713772189} 7 Si27 74 0.0 1 14 {} {0.834138264078 0.856823885527 0.545400739096} 0 Si28 75 0.0 1 8 {} {0.547834791861 0.492472344872 0.106007612189} 7 O48 76 0.0 1 8 {} {0.581503611861 0.582496954872 0.438356762189} 7 O49 77 0.0 1 8 {} {0.819792461861 0.699161104872 0.251716912189} 7 O50 78 0.0 1 8 {} {0.822017980408 0.719793288501 0.58725646425} 0 O51 79 0.0 1 8 {} {0.648245241861 0.739339904872 0.107799592189} 7 O52 80 0.0 1 8 {} {0.642078271861 0.834194884872 0.411219302189} 7 O53 81 0.0 1 8 {} {0.883202951861 0.948084184872 0.281861572189} 7 O54 82 0.0 1 8 {} {0.882945257539 0.979104275743 0.594029571643} 0 O55 83 0.0 1 8 {} {0.978741431861 0.838092204872 0.183154542189} 7 O56 84 0.0 1 8 {} {0.930289091861 0.832071634872 0.486296072189} 7 O57 85 0.0 1 8 {} {0.720409541861 0.913009034872 0.191921702189} 7 O58 86 0.0 1 8 {} {0.686922623763 0.908976951202 0.519515719147} 0 O59 87 0.0 1 8 {} {0.769855281861 0.625497024872 0.360065402189} 7 O60 88 0.0 1 8 {} {0.672420961991 0.573574967608 0.665547611412} 0 O61 89 0.0 1 8 {} {0.513820881861 0.684917634872 0.334504852189} 7 O62 90 0.0 1 8 {} {0.399367748111 0.619083188457 0.673090562467} 0 O63 91 0.0 1 1 {} {0.0967915018607 0.115537264872 0.107740112189} 7 H1 92 0.0 1 1 {} {0.193364541861 0.301292744872 0.073019522189} 7 H2 93 0.0 1 1 {} {0.0895797018607 0.615576424872 0.110035072189} 7 H3 94 0.0 1 1 {} {0.203678491861 0.791602894872 0.071338172189} 7 H4 95 0.0 1 1 {} {0.585996231861 0.0874080448719 0.108517422189} 7 H5 96 0.0 1 1 {} {0.682739691861 0.267541054872 0.072060392189} 7 H6 97 0.0 1 1 {} {0.586266541861 0.587110344872 0.108789432189} 7 H7 98 0.0 1 1 {} {0.688228401861 0.765275114872 0.071383702189} 7 H8 99 0.0 1 14 {} {0.964140081161 0.389789166437 0.650580178789} 0 Si29 100 0.0 1 14 {} {0.543035216076 0.219294784559 0.653635301716} 0 Si30 101 0.0 1 8 {} {0.562385942271 0.337293483634 0.700939900211} 0 O64 102 0.0 1 14 {} {0.626041033718 0.483822714218 0.722308892475} 0 Si31 103 0.0 1 8 {} {0.543050331733 0.278499272637 0.587601507809} 0 O65 104 0.0 1 1 {} {0.612776854738 0.23354007081 0.563630937973} 0 H9 105 0.0 1 1 {} {0.0807319577187 0.0182097773622 0.618336145766} 0 H10 106 0.0 1 8 {} {0.83404343937 0.784461480842 0.699718757677} 0 O66 107 0.0 1 1 {} {0.771503354628 0.861785058444 0.696339516713} 0 H11 108 0.0 1 8 {} {0.121038742789 0.366537651126 0.67164841993} 0 O67 109 0.0 1 1 {} {0.146133563339 0.269136403905 0.672718887029} 0 H12 110 0.0 1 8 {} {0.1567564799 0.650408850473 0.62109685582} 0 O68 111 0.0 1 1 {} {0.105133037349 0.61879079664 0.654445081035} 0 H13 112 0.0 1 8 {} {0.759248744728 0.435082425174 0.760939415485} 0 O69 113 0.0 1 1 {} {0.830629411197 0.503282624827 0.766795175144} 0 H14 114 0.0 1 8 {} {0.523995399562 0.569172920557 0.766122687524} 0 O70 115 0.0 1 1 {} {0.552375875159 0.557862216211 0.805739190827} 0 H15 116 0.0 1 1 {} {0.371335205792 0.680216458756 0.702945657234} 0 H16 117 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} {9.74432 9.74432 23.42768 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{9.74432 0 0} {0 9.74432 0} {0 0 23.42768}} {{0.102623887557 0 0} {0 0.102623887557 0} {0 0 0.0426845509244}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 76 68 0 0 49 16 0 0 16 6 0 0 57 45 0 0 84 74 0 0 71 52 0 0 61 4 0 0 35 27 0 0 102 88 0 0 60 50 0 0 81 46 0 0 95 52 0 0 39 29 0 0 13 5 0 0 21 0 0 0 46 21 0 0 43 23 0 0 59 51 0 0 103 100 0 0 26 7 0 0 17 5 0 0 37 29 0 0 66 45 0 0 32 28 0 0 70 44 0 0 77 73 0 0 105 20 0 0 80 72 0 0 48 15 0 0 58 50 0 0 12 0 0 0 17 3 0 0 40 26 0 0 85 71 0 0 55 47 0 0 40 28 0 0 27 8 0 0 90 25 0 0 31 23 0 0 19 0 0 0 14 6 0 0 42 23 0 0 82 74 0 0 37 2 0 0 93 30 0 0 63 51 0 0 79 71 0 0 8 0 0 0 57 49 0 0 76 49 0 0 25 14 0 0 33 25 0 0 106 70 0 0 65 47 0 0 78 70 0 0 89 24 0 0 67 2 0 0 75 48 0 0 31 4 0 0 116 90 0 0 96 56 0 0 101 100 0 0 87 69 0 0 84 27 0 0 10 2 0 0 94 34 0 0 69 58 0 0 77 69 0 0 107 106 0 0 10 6 0 0 53 45 0 0 109 108 0 0 36 28 0 0 87 68 0 0 35 23 0 0 61 51 0 0 82 47 0 0 80 68 0 0 18 6 0 0 89 68 0 0 33 29 0 0 78 74 0 0 81 73 0 0 108 99 0 0 69 43 0 0 102 101 0 0 18 4 0 0 41 27 0 0 54 50 0 0 86 72 0 0 56 48 0 0 41 29 0 0 104 103 0 0 9 1 0 0 32 24 0 0 92 11 0 0 9 5 0 0 112 102 0 0 72 53 0 0 110 25 0 0 91 7 0 0 111 110 0 0 34 26 0 0 113 112 0 0 19 1 0 0 42 24 0 0 115 114 0 0 64 46 0 0 11 3 0 0 30 3 0 0 85 73 0 0 47 22 0 0 60 3 0 0 54 46 0 0 97 75 0 0 66 1 0 0 88 70 0 0 99 59 0 0 114 102 0 0 83 26 0 0 24 13 0 0 99 44 0 0 64 45 0 0 98 79 0 0 55 51 0 0 71 38 0 0 15 5 0 0 100 67 0 0 100 65 0 0 62 48 0 0 12 4 0 0 86 74 0 0 20 2 0 0 62 50 0 0 38 28 0 0 83 73 0 0 72 39 0 0 99 22 0 0 63 49 0 0 36 1 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 68 76 {0 0 0} 0 1 16 49 {0 0 0} 0 2 6 16 {0 0 0} 0 3 45 57 {0 0 0} 0 4 74 84 {0 0 0} 0 5 52 71 {0 0 0} 0 6 4 61 {-1 0 0} 0 7 35 27 {0 0 0} 0 8 102 88 {0 0 0} 0 9 50 60 {0 0 0} 0 10 81 46 {0 1 0} 0 11 52 95 {0 1 0} 0 12 39 29 {0 0 0} 0 13 13 5 {0 0 0} 0 14 0 21 {0 0 0} 0 15 21 46 {-1 0 0} 0 16 23 43 {0 0 0} 0 17 59 51 {0 0 0} 0 18 100 103 {0 0 0} 0 19 7 26 {0 -1 0} 0 20 17 5 {0 0 0} 0 21 29 37 {0 0 0} 0 22 66 45 {0 0 0} 0 23 28 32 {0 0 0} 0 24 44 70 {0 0 0} 0 25 73 77 {0 0 0} 0 26 20 105 {0 0 0} 0 27 80 72 {0 0 0} 0 28 48 15 {0 0 0} 0 29 50 58 {0 0 0} 0 30 12 0 {0 0 0} 0 31 3 17 {0 0 0} 0 32 26 40 {0 0 0} 0 33 71 85 {0 0 0} 0 34 55 47 {0 0 0} 0 35 40 28 {0 0 0} 0 36 8 27 {0 -1 0} 0 37 90 25 {0 0 0} 0 38 31 23 {0 0 0} 0 39 0 19 {0 0 0} 0 40 6 14 {0 0 0} 0 41 23 42 {0 0 0} 0 42 74 82 {0 0 0} 0 43 37 2 {0 1 0} 0 44 30 93 {0 0 0} 0 45 51 63 {0 0 0} 0 46 79 71 {0 0 0} 0 47 0 8 {0 0 0} 0 48 49 57 {0 0 0} 0 49 49 76 {0 0 0} 0 50 25 14 {0 0 0} 0 51 25 33 {0 0 0} 0 52 106 70 {0 0 0} 0 53 47 65 {0 0 0} 0 54 70 78 {0 0 0} 0 55 89 24 {0 0 0} 0 56 2 67 {0 0 0} 0 57 75 48 {0 0 0} 0 58 31 4 {0 0 0} 0 59 90 116 {0 0 0} 0 60 96 56 {0 0 0} 0 61 100 101 {0 0 0} 0 62 87 69 {0 0 0} 0 63 84 27 {1 0 0} 0 64 2 10 {0 0 0} 0 65 34 94 {0 0 0} 0 66 69 58 {0 0 0} 0 67 69 77 {0 0 0} 0 68 106 107 {0 0 0} 0 69 10 6 {0 0 0} 0 70 45 53 {0 0 0} 0 71 108 109 {0 0 0} 0 72 36 28 {0 0 0} 0 73 87 68 {0 0 0} 0 74 35 23 {0 0 0} 0 75 51 61 {0 0 0} 0 76 82 47 {0 1 0} 0 77 80 68 {0 0 0} 0 78 18 6 {0 0 0} 0 79 68 89 {0 0 0} 0 80 29 33 {0 0 0} 0 81 74 78 {0 0 0} 0 82 81 73 {0 0 0} 0 83 99 108 {1 0 0} 0 84 43 69 {-1 0 0} 0 85 102 101 {0 0 0} 0 86 4 18 {0 0 0} 0 87 27 41 {0 0 0} 0 88 50 54 {0 0 0} 0 89 72 86 {0 0 0} 0 90 56 48 {0 0 0} 0 91 41 29 {0 0 0} 0 92 104 103 {0 0 0} 0 93 1 9 {0 0 0} 0 94 32 24 {0 0 0} 0 95 11 92 {0 0 0} 0 96 5 9 {0 0 0} 0 97 112 102 {0 0 0} 0 98 53 72 {0 -1 0} 0 99 110 25 {0 0 0} 0 100 7 91 {0 0 0} 0 101 111 110 {0 0 0} 0 102 26 34 {0 0 0} 0 103 113 112 {0 0 0} 0 104 1 19 {0 0 0} 0 105 24 42 {0 0 0} 0 106 115 114 {0 0 0} 0 107 64 46 {0 0 0} 0 108 3 11 {0 0 0} 0 109 3 30 {0 0 0} 0 110 85 73 {0 0 0} 0 111 47 22 {0 0 0} 0 112 60 3 {1 0 0} 0 113 46 54 {0 0 0} 0 114 97 75 {0 0 0} 0 115 66 1 {0 0 0} 0 116 88 70 {0 0 0} 0 117 59 99 {0 0 0} 0 118 114 102 {0 0 0} 0 119 26 83 {-1 0 0} 0 120 13 24 {0 0 0} 0 121 44 99 {0 0 0} 0 122 64 45 {0 0 0} 0 123 98 79 {0 0 0} 0 124 51 55 {0 0 0} 0 125 71 38 {0 0 0} 0 126 15 5 {0 0 0} 0 127 100 67 {0 0 0} 0 128 65 100 {0 0 0} 0 129 48 62 {0 0 0} 0 130 4 12 {0 0 0} 0 131 86 74 {0 0 0} 0 132 2 20 {0 0 0} 0 133 62 50 {0 0 0} 0 134 28 38 {0 0 0} 0 135 73 83 {0 0 0} 0 136 72 39 {0 0 0} 0 137 22 99 {0 0 0} 0 138 49 63 {0 0 0} 0 139 1 36 {0 -1 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