#MD System 2.0 @Title neb0_image09 @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 {} {0.849543624756 0.308011991468 0.0624753489236} Si1 1 0.0 1 14 {} {0.850195085032 0.385339410993 0.444317908027} Si2 2 0.0 1 14 {} {0.0995067521501 0.307679152294 0.19248674466} Si3 3 0.0 1 14 {} {0.0995921163576 0.38363767156 0.317666358566} Si4 4 0.0 1 14 {} {0.859993485797 0.542905909748 0.439789628042} Si5 5 0.0 1 14 {} {0.103424955128 0.53779455731 0.304857189466} Si6 6 0.0 1 14 {} {0.847299793495 0.459107663823 0.0666271672868} Si7 7 0.0 1 14 {} {0.845915318518 0.230041936164 0.442234969074} Si8 8 0.0 1 14 {} {0.0993455466308 0.458701401349 0.192310105279} Si9 9 0.0 1 14 {} {0.0956633395429 0.229242974188 0.313621872381} Si10 10 0.0 1 8 {} {0.33573407752 0.592768279674 0.522576923175} O1 11 0.0 1 14 {} {0.35113465324 0.659134453239 0.517728689556} Si11 12 0.0 1 8 {} {0.113158564035 0.589480869922 0.208431582286} O2 13 0.0 1 1 {} {0.013010403259 0.594384111838 0.149016272344} H1 14 0.0 1 8 {} {0.33485524274 0.178101714014 0.540290537131} O3 15 0.0 1 1 {} {0.933738958104 0.175342202029 0.600974330206} H2 16 0.0 1 8 {} {0.0845591255174 0.177498031992 0.215908884704} O4 17 0.0 1 1 {} {0.183565762881 0.173946164444 0.155800340189} H3 18 0.0 1 14 {} {0.850168119265 0.308277428327 0.565104089297} Si12 19 0.0 1 14 {} {0.849410667357 0.38473498703 0.938977311578} Si13 20 0.0 1 14 {} {0.0998259908273 0.309639037797 0.694743049897} Si14 21 0.0 1 14 {} {0.100562863785 0.38826763066 0.813192727239} Si15 22 0.0 1 14 {} {0.852487471606 0.537554041696 0.951018176364} Si16 23 0.0 1 14 {} {0.103777811441 0.543104380069 0.820698051368} Si17 24 0.0 1 14 {} {0.851219056387 0.464464897972 0.559969270984} Si18 25 0.0 1 14 {} {0.845954155037 0.229327338332 0.942558224103} Si19 26 0.0 1 14 {} {0.10128364398 0.466581381913 0.690226392215} Si20 27 0.0 1 14 {} {0.096155339021 0.230534489871 0.814898489582} Si21 28 0.0 1 8 {} {0.363826340326 0.589498220744 0.0467127484785} O5 29 0.0 1 1 {} {0.263517439654 0.59415262579 0.106892953822} H4 30 0.0 1 8 {} {0.1092466531 0.604403067181 0.781253284865} O6 31 0.0 1 1 {} {0.10838687697 0.62621485195 0.704239055782} H5 32 0.0 1 8 {} {0.33485704489 0.177822830534 0.041060035255} O7 33 0.0 1 1 {} {0.933870919758 0.17414150671 0.100990525208} H6 34 0.0 1 8 {} {0.0849768789577 0.180008834857 0.713813321986} O8 35 0.0 1 1 {} {0.184550272982 0.176114677134 0.654120677449} H7 36 0.0 1 14 {} {0.349619367121 0.308020622506 0.0625859241821} Si22 37 0.0 1 14 {} {0.350175338571 0.384902919794 0.443373013144} Si23 38 0.0 1 14 {} {0.59964645117 0.308249339341 0.19245753146} Si24 39 0.0 1 14 {} {0.600743165024 0.384147669505 0.318117813184} Si25 40 0.0 1 14 {} {0.351576694073 0.541426086361 0.435976628458} Si26 41 0.0 1 14 {} {0.606967476306 0.542052383933 0.312046607289} Si27 42 0.0 1 14 {} {0.354107094766 0.458963051929 0.0690355218939} Si28 43 0.0 1 14 {} {0.345502937975 0.229682247673 0.442099132604} Si29 44 0.0 1 14 {} {0.602534680525 0.461243428471 0.199585963632} Si30 45 0.0 1 14 {} {0.595782362391 0.22979717848 0.313863695259} Si31 46 0.0 1 8 {} {0.874047790729 0.591003575601 0.540021339522} O9 47 0.0 1 1 {} {0.952177302107 0.621950583836 0.533454640237} H8 48 0.0 1 8 {} {0.616691211176 0.591483533095 0.209931007703} O10 49 0.0 1 1 {} {0.515159167687 0.595610891483 0.151207822624} H9 50 0.0 1 8 {} {0.834601744317 0.178579511927 0.540736946434} O11 51 0.0 1 1 {} {0.433853514585 0.174732746906 0.600553107885} H10 52 0.0 1 8 {} {0.585038139634 0.178139306863 0.215885364162} O12 53 0.0 1 1 {} {0.684003235254 0.174493037589 0.155758990129} H11 54 0.0 1 14 {} {0.34909735958 0.307919699671 0.564790754791} Si32 55 0.0 1 14 {} {0.351266722491 0.384920107821 0.939757573384} Si33 56 0.0 1 14 {} {0.599479123791 0.308768956315 0.69355971307} Si34 57 0.0 1 14 {} {0.600225214631 0.386901545169 0.812117169907} Si35 58 0.0 1 14 {} {0.354108574887 0.537143631753 0.953542283503} Si36 59 0.0 1 14 {} {0.601019551667 0.541555646223 0.818855808917} Si37 60 0.0 1 14 {} {0.351656469437 0.463877461506 0.560359479671} Si38 61 0.0 1 14 {} {0.346190859569 0.22932483272 0.942689885641} Si39 62 0.0 1 14 {} {0.601583928297 0.465013033166 0.690778118639} Si40 63 0.0 1 14 {} {0.595997578818 0.230034349811 0.814594336338} Si41 64 0.0 1 8 {} {0.861508744218 0.590131492105 0.0437224038004} O13 65 0.0 1 1 {} {0.763084108823 0.594503100881 0.105595515711} H12 66 0.0 1 8 {} {0.596265788133 0.597029768116 0.743530683906} O14 67 0.0 1 14 {} {0.590410509766 0.662887943534 0.743631488046} Si42 68 0.0 1 8 {} {0.834869567462 0.177819565582 0.0408966565426} O15 69 0.0 1 1 {} {0.433854121815 0.174310249239 0.101203048323} H13 70 0.0 1 8 {} {0.584744882043 0.179240398057 0.714260199835} O16 71 0.0 1 1 {} {0.684090513836 0.175683050896 0.654259116461} H14 72 0.0 1 7 {} {0.444431566082 0.688626319126 0.644709806636} N 73 0.0 1 1 {} {0.440848086217 0.752211961346 0.649607866836} H16 74 0.0 1 9 {} {0.787817539973 0.680440690455 0.720653242958} F4 75 0.0 1 9 {} {0.26447795753 0.681967172825 0.392780100801} F5 76 0.0 1 9 {} {0.543382919157 0.679781520734 0.881724004262} F3 77 0.0 1 9 {} {0.140161267047 0.662802561244 0.586502546396} F1 78 0.0 1 9 {} {0.436141357715 0.79086110894 0.660959397173} F2 79 0.0 1 9 {} {0.552786349276 0.658239291454 0.454895858953} 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