#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 {} {0.849450901397 0.307687346903 0.0629846257102} Si1 1 0.0 1 14 {} {0.849759028115 0.385222962139 0.444659134476} Si2 2 0.0 1 14 {} {0.0994857621081 0.307477438902 0.193034686326} Si3 3 0.0 1 14 {} {0.0997676307759 0.383504272846 0.318604330008} Si4 4 0.0 1 14 {} {0.860140077545 0.541721626019 0.439003299904} Si5 5 0.0 1 14 {} {0.106518353006 0.538415173329 0.306276526236} Si6 6 0.0 1 14 {} {0.851514835507 0.458647075329 0.0654630049998} Si7 7 0.0 1 14 {} {0.845572645622 0.22968789683 0.442226891721} Si8 8 0.0 1 14 {} {0.100856479669 0.458751551477 0.194243711129} Si9 9 0.0 1 14 {} {0.095474898928 0.228968333704 0.313850550859} Si10 10 0.0 1 8 {} {0.362734023877 0.595256029556 0.517565256021} O1 11 0.0 1 14 {} {0.353717236986 0.662199476532 0.516646281725} Si11 12 0.0 1 8 {} {0.111528965418 0.589692456261 0.209043300435} O2 13 0.0 1 1 {} {0.0110095186644 0.593662410863 0.149221564225} H1 14 0.0 1 8 {} {0.334602694993 0.178552201183 0.54080994192} O3 15 0.0 1 1 {} {0.933578669421 0.175056334697 0.601180442638} H2 16 0.0 1 8 {} {0.0844092262213 0.177275012949 0.216017515118} O4 17 0.0 1 1 {} {0.183338556479 0.173683644333 0.155804699655} H3 18 0.0 1 14 {} {0.849690331093 0.307973681876 0.565026751674} Si12 19 0.0 1 14 {} {0.85047198781 0.384161041901 0.938396454759} Si13 20 0.0 1 14 {} {0.0998915321055 0.309223840817 0.694005362931} Si14 21 0.0 1 14 {} {0.100391202726 0.387780560726 0.811952344884} Si15 22 0.0 1 14 {} {0.85075409917 0.537598712564 0.950875405943} Si16 23 0.0 1 14 {} {0.102703163087 0.543073082986 0.823464128824} Si17 24 0.0 1 14 {} {0.850824756876 0.46408541132 0.561774785461} Si18 25 0.0 1 14 {} {0.84567422614 0.228987860747 0.942655608769} Si19 26 0.0 1 14 {} {0.100379283492 0.466821117388 0.692209830913} Si20 27 0.0 1 14 {} {0.0958856978635 0.230198853617 0.814773717205} Si21 28 0.0 1 8 {} {0.364317431495 0.588778067468 0.0477928732452} O5 29 0.0 1 1 {} {0.263125626 0.594280924789 0.106357289284} H4 30 0.0 1 8 {} {0.127808260251 0.602992807683 0.776313415327} O6 31 0.0 1 1 {} {0.0911724691057 0.623560280851 0.702931072786} H5 32 0.0 1 8 {} {0.334447875422 0.177390439806 0.041077706703} O7 33 0.0 1 1 {} {0.933544112169 0.173788126863 0.101016134817} H6 34 0.0 1 8 {} {0.0846422452648 0.179516206796 0.71413461571} O8 35 0.0 1 1 {} {0.184149088314 0.175745946753 0.654305414006} H7 36 0.0 1 14 {} {0.349244552724 0.307523970435 0.0628799574629} Si22 37 0.0 1 14 {} {0.349651601714 0.386120423707 0.444677841798} Si23 38 0.0 1 14 {} {0.59914588929 0.307842882874 0.193038890055} Si24 39 0.0 1 14 {} {0.59979889391 0.38390138813 0.318670187481} Si25 40 0.0 1 14 {} {0.357916107595 0.542429092851 0.435311759552} Si26 41 0.0 1 14 {} {0.609935409519 0.539450573782 0.307799730164} Si27 42 0.0 1 14 {} {0.352215980085 0.458171199484 0.068050724242} Si28 43 0.0 1 14 {} {0.34544064948 0.22991571114 0.442053303187} Si29 44 0.0 1 14 {} {0.603509414648 0.459382165539 0.194910841931} Si30 45 0.0 1 14 {} {0.595510069712 0.229270866613 0.313886272682} Si31 46 0.0 1 8 {} {0.870421100275 0.59125570058 0.535761843921} O9 47 0.0 1 1 {} {0.940756494776 0.623401212265 0.520746025211} H8 48 0.0 1 8 {} {0.61641793257 0.590769728801 0.210801175886} O10 49 0.0 1 1 {} {0.514171454913 0.595007092468 0.15259161277} H9 50 0.0 1 8 {} {0.834411496636 0.178296241672 0.540929131818} O11 51 0.0 1 1 {} {0.433892121982 0.174842588488 0.600748180907} H10 52 0.0 1 8 {} {0.584656362401 0.177626130876 0.215865292243} O12 53 0.0 1 1 {} {0.683625525754 0.174034268028 0.155679632815} H11 54 0.0 1 14 {} {0.34919461121 0.308457671857 0.564258736568} Si32 55 0.0 1 14 {} {0.34991294896 0.384155151985 0.939212018727} Si33 56 0.0 1 14 {} {0.599013071183 0.308455639601 0.693540107218} Si34 57 0.0 1 14 {} {0.599825412139 0.386530337116 0.812463381006} Si35 58 0.0 1 14 {} {0.351702350164 0.536568954175 0.953819651873} Si36 59 0.0 1 14 {} {0.598717201923 0.540939069736 0.821757460125} Si37 60 0.0 1 14 {} {0.350321871439 0.465306637896 0.56165223} Si38 61 0.0 1 14 {} {0.345760876483 0.228888596227 0.942743473803} Si39 62 0.0 1 14 {} {0.600212541612 0.464912713381 0.69189535494} Si40 63 0.0 1 14 {} {0.595558097168 0.229663763404 0.814590502732} Si41 64 0.0 1 8 {} {0.860819725698 0.589856510676 0.0450258659446} O13 65 0.0 1 1 {} {0.761066354976 0.594734527006 0.105551380397} H12 66 0.0 1 8 {} {0.593779639268 0.596454968341 0.74638324718} O14 67 0.0 1 14 {} {0.587555766207 0.6619136785 0.747761011392} Si42 68 0.0 1 8 {} {0.834609680485 0.177409436343 0.0408230648513} O15 69 0.0 1 1 {} {0.433487831052 0.173889145981 0.1012314531} H13 70 0.0 1 8 {} {0.584663620179 0.178779109971 0.714504723703} O16 71 0.0 1 1 {} {0.683976250725 0.175261035589 0.654421388517} H14 72 0.0 1 7 {} {0.435077115496 0.688295974888 0.653797149693} N 73 0.0 1 1 {} {0.430468402945 0.75408693376 0.661242483247} H16 74 0.0 1 9 {} {0.781299940639 0.680508971784 0.716297645451} F4 75 0.0 1 9 {} {0.275718529275 0.681708099754 0.385183357958} F5 76 0.0 1 9 {} {0.55213745295 0.678049915457 0.887966396875} F3 77 0.0 1 9 {} {0.140743429702 0.661996112009 0.573476927743} F1 78 0.0 1 9 {} {0.435757662643 0.793208561394 0.659720030647} F2 79 0.0 1 9 {} {0.560608401684 0.673743345901 0.464831216722} 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