#MD System 2.0 @Title neb0_image07 @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 {} {0.849059579452 0.307501418587 0.06318379947} Si1 1 0.0 1 14 {} {0.84988857135 0.385171864709 0.444630319079} Si2 2 0.0 1 14 {} {0.0990936957752 0.307337087939 0.192686059529} Si3 3 0.0 1 14 {} {0.0993164377575 0.383470485681 0.317687642921} Si4 4 0.0 1 14 {} {0.856855781971 0.541182028699 0.436819124129} Si5 5 0.0 1 14 {} {0.105153143985 0.538468925729 0.308764293865} Si6 6 0.0 1 14 {} {0.850948300503 0.45868690232 0.0658327253307} Si7 7 0.0 1 14 {} {0.845314884867 0.229620872873 0.442034528046} Si8 8 0.0 1 14 {} {0.100722803179 0.458955035877 0.19406308195} Si9 9 0.0 1 14 {} {0.0952012250554 0.228877977028 0.313967100381} Si10 10 0.0 1 8 {} {0.372983001741 0.596147125263 0.515637057152} O1 11 0.0 1 14 {} {0.343271329104 0.661154268256 0.515751480183} Si11 12 0.0 1 8 {} {0.111362976935 0.589575122773 0.210506930285} O2 13 0.0 1 1 {} {0.0115387617449 0.593249930236 0.150113050313} H1 14 0.0 1 8 {} {0.334575277639 0.178182614883 0.54073016564} O3 15 0.0 1 1 {} {0.933400130255 0.175118384181 0.601288210789} H2 16 0.0 1 8 {} {0.0842263935569 0.177153504942 0.216030543931} O4 17 0.0 1 1 {} {0.183092633064 0.173712360982 0.155786690537} H3 18 0.0 1 14 {} {0.84936602555 0.307916571858 0.565062104401} Si12 19 0.0 1 14 {} {0.849699085513 0.384016240511 0.939034294913} Si13 20 0.0 1 14 {} {0.0994406641605 0.308912308041 0.693831569603} Si14 21 0.0 1 14 {} {0.100202798799 0.387493593025 0.812589511162} Si15 22 0.0 1 14 {} {0.849303203351 0.537430982688 0.94881687187} Si16 23 0.0 1 14 {} {0.102303811436 0.543177531329 0.825851385958} Si17 24 0.0 1 14 {} {0.851079475862 0.463844844433 0.562899122496} Si18 25 0.0 1 14 {} {0.84532585808 0.228891874757 0.942535637133} Si19 26 0.0 1 14 {} {0.100162039613 0.466813353859 0.692570345148} Si20 27 0.0 1 14 {} {0.095548315444 0.229901316022 0.815126552863} Si21 28 0.0 1 8 {} {0.36455558061 0.588634031729 0.0467796314323} O5 29 0.0 1 1 {} {0.263989470901 0.593915265342 0.105394467253} H4 30 0.0 1 8 {} {0.142057935867 0.603103408192 0.771137915361} O6 31 0.0 1 1 {} {0.0605439475086 0.620235553141 0.716144744671} H5 32 0.0 1 8 {} {0.334337512708 0.17730693721 0.0409934203015} O7 33 0.0 1 1 {} {0.933317455219 0.173827576413 0.101076440483} H6 34 0.0 1 8 {} {0.0845080624681 0.179231047365 0.714223642143} O8 35 0.0 1 1 {} {0.1839112932 0.175616907293 0.65431851015} H7 36 0.0 1 14 {} {0.349020331504 0.307569826088 0.063122200086} Si22 37 0.0 1 14 {} {0.348923655296 0.386451545719 0.444968380147} Si23 38 0.0 1 14 {} {0.598999048051 0.307555046829 0.192546272445} Si24 39 0.0 1 14 {} {0.599596379607 0.383681528485 0.318210540179} Si25 40 0.0 1 14 {} {0.357848586791 0.540849625818 0.430616055978} Si26 41 0.0 1 14 {} {0.607844376272 0.538768806368 0.308322265287} Si27 42 0.0 1 14 {} {0.351242397202 0.458406634323 0.0677416760337} Si28 43 0.0 1 14 {} {0.345326814312 0.229581276165 0.441792276438} Si29 44 0.0 1 14 {} {0.602157181531 0.459285125544 0.194394528646} Si30 45 0.0 1 14 {} {0.595388689641 0.229167335944 0.314063599906} Si31 46 0.0 1 8 {} {0.862385259134 0.592051587433 0.533199222753} O9 47 0.0 1 1 {} {0.939688268933 0.622058421226 0.518503134781} H8 48 0.0 1 8 {} {0.614649000529 0.590897373607 0.212649115362} O10 49 0.0 1 1 {} {0.51359219318 0.594079240781 0.153268210362} H9 50 0.0 1 8 {} {0.834290055046 0.178269038418 0.541010432241} O11 51 0.0 1 1 {} {0.433656670099 0.174745790101 0.600925728193} H10 52 0.0 1 8 {} {0.584526512697 0.177534801101 0.215897364299} O12 53 0.0 1 1 {} {0.68341952899 0.174062375518 0.155702537116} H11 54 0.0 1 14 {} {0.349000222686 0.308342711337 0.564520258901} Si32 55 0.0 1 14 {} {0.350025164981 0.384234049235 0.939682517118} Si33 56 0.0 1 14 {} {0.598939621648 0.308250053527 0.693485298729} Si34 57 0.0 1 14 {} {0.599431466829 0.386200446878 0.812765391} Si35 58 0.0 1 14 {} {0.349100826772 0.53651880679 0.951554612008} Si36 59 0.0 1 14 {} {0.597601670494 0.539169927973 0.825605864988} Si37 60 0.0 1 14 {} {0.349963482438 0.465996877189 0.562314651841} Si38 61 0.0 1 14 {} {0.345584581917 0.228857650821 0.942638697007} Si39 62 0.0 1 14 {} {0.599996040548 0.464559783314 0.691340041584} Si40 63 0.0 1 14 {} {0.595362099078 0.229543605741 0.814842645158} Si41 64 0.0 1 8 {} {0.860913506813 0.58970812913 0.0445712463013} O13 65 0.0 1 1 {} {0.761660414061 0.594362322909 0.104697982705} H12 66 0.0 1 8 {} {0.598771597329 0.595027239382 0.745698201093} O14 67 0.0 1 14 {} {0.597924245765 0.659186364054 0.745597852142} Si42 68 0.0 1 8 {} {0.834466647557 0.177331591101 0.0408460686246} O15 69 0.0 1 1 {} {0.43320981543 0.173907566638 0.101227988319} H13 70 0.0 1 8 {} {0.584455922635 0.178668965095 0.714556642041} O16 71 0.0 1 1 {} {0.683698197739 0.17529685901 0.654413884566} H14 72 0.0 1 7 {} {0.447920466889 0.689184849594 0.64765353132} N 73 0.0 1 1 {} {0.433583450913 0.753176012728 0.659786955493} H16 74 0.0 1 9 {} {0.791299941579 0.679074139784 0.716479164134} F4 75 0.0 1 9 {} {0.29625602811 0.680138766251 0.376146456699} F5 76 0.0 1 9 {} {0.548302811565 0.680217055929 0.87962798707} F3 77 0.0 1 9 {} {0.137896496442 0.66782427693 0.567834591934} F1 78 0.0 1 9 {} {0.432227432251 0.792681275924 0.662406284356} F2 79 0.0 1 9 {} {0.560238141317 0.688124347832 0.493123979302} 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 58 42 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 2 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 0 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 42 58 {0 0 -1} 0 6 3 1 {-1 0 0} 0 7 20 27 {0 0 0} 0 8 56 54 {0 0 0} 0 9 3 37 {0 0 0} 0 10 26 60 {0 0 0} 0 11 62 24 {0 0 0} 0 12 17 16 {0 0 0} 0 13 54 43 {0 0 0} 0 14 43 45 {0 0 0} 0 15 25 27 {1 0 0} 0 16 26 21 {0 0 0} 0 17 40 10 {0 0 0} 0 18 44 6 {0 0 0} 0 19 11 77 {0 0 0} 0 20 61 36 {0 0 1} 0 21 0 38 {0 0 0} 0 22 0 2 {1 0 0} 0 23 57 19 {0 0 0} 0 24 13 12 {0 0 0} 0 25 25 0 {0 0 1} 0 26 47 46 {0 0 0} 0 27 75 11 {0 0 0} 0 28 62 60 {0 0 0} 0 29 1 24 {0 0 0} 0 30 7 18 {0 0 0} 0 31 37 54 {0 0 0} 0 32 28 29 {0 0 0} 0 33 57 56 {0 0 0} 0 34 18 56 {0 0 0} 0 35 28 58 {0 0 -1} 0 36 8 42 {0 0 0} 0 37 38 39 {0 0 0} 0 38 67 66 {0 0 0} 0 39 59 66 {0 0 0} 0 40 3 2 {0 0 0} 0 41 57 55 {0 0 0} 0 42 0 19 {0 0 -1} 0 43 27 61 {0 0 0} 0 44 63 25 {0 0 0} 0 45 48 49 {0 0 0} 0 46 54 20 {0 0 0} 0 47 68 33 {0 0 0} 0 48 39 44 {0 0 0} 0 49 62 57 {0 0 0} 0 50 25 68 {0 0 1} 0 51 6 8 {1 0 0} 0 52 53 52 {0 0 0} 0 53 45 52 {0 0 0} 0 54 45 7 {0 0 0} 0 55 72 11 {0 0 0} 0 56 50 7 {0 0 0} 0 57 72 67 {0 0 0} 0 58 34 35 {0 0 0} 0 59 41 48 {0 0 0} 0 60 10 11 {0 0 0} 0 61 8 5 {0 0 0} 0 62 1 39 {0 0 0} 0 63 61 32 {0 0 1} 0 64 14 51 {0 0 0} 0 65 50 15 {0 0 0} 0 66 20 21 {0 0 0} 0 67 63 61 {0 0 0} 0 68 55 42 {0 0 1} 0 69 38 36 {0 0 0} 0 70 30 31 {0 0 0} 0 71 26 24 {-1 0 0} 0 72 64 65 {0 0 0} 0 73 9 43 {0 0 0} 0 74 76 67 {0 0 0} 0 75 1 18 {0 0 0} 0 76 8 3 {0 0 0} 0 77 7 9 {1 0 0} 0 78 55 21 {0 0 0} 0 79 19 6 {0 0 1} 0 80 44 42 {0 0 0} 0 81 36 2 {0 0 0} 0 82 56 63 {0 0 0} 0 83 70 71 {0 0 0} 0 84 16 9 {0 0 0} 0 85 2 9 {0 0 0} 0 86 69 32 {0 0 0} 0 87 39 37 {0 0 0} 0 88 22 64 {0 0 1} 0 89 27 34 {0 0 0} 0 90 20 18 {-1 0 0} 0 91 55 36 {0 0 1} 0 92 43 14 {0 0 0} 0 93 46 4 {0 0 0} 0 94 23 30 {0 0 0} 0 95 60 37 {0 0 0} 0 96 12 5 {0 0 0} 0 97 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