#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 {} {0.849708876541 0.307862579263 0.0626464166534} Si1 1 0.0 1 14 {} {0.850195430699 0.385205911773 0.444523980404} Si2 2 0.0 1 14 {} {0.0996376293007 0.307587321362 0.192774497379} Si3 3 0.0 1 14 {} {0.100096137671 0.383582126916 0.318208628827} Si4 4 0.0 1 14 {} {0.861590276129 0.54241955785 0.439332558775} Si5 5 0.0 1 14 {} {0.104640039307 0.537961510502 0.304716368977} Si6 6 0.0 1 14 {} {0.849541983368 0.458843772452 0.0657073945774} Si7 7 0.0 1 14 {} {0.845902293574 0.229899551192 0.442326236404} Si8 8 0.0 1 14 {} {0.100117648265 0.4587192614 0.1931852668} Si9 9 0.0 1 14 {} {0.0956827405027 0.229134356117 0.313699358601} Si10 10 0.0 1 8 {} {0.340264614484 0.592083122118 0.525220362906} O1 11 0.0 1 14 {} {0.353916340366 0.659271500536 0.516956623117} Si11 12 0.0 1 8 {} {0.112810059571 0.589615069451 0.208297452306} O2 13 0.0 1 1 {} {0.0120951136742 0.59417269086 0.149036172222} H1 14 0.0 1 8 {} {0.334893070317 0.178345537664 0.540495444388} O3 15 0.0 1 1 {} {0.933799015669 0.175227744722 0.601035852731} H2 16 0.0 1 8 {} {0.0846279227885 0.177408419812 0.215929255068} O4 17 0.0 1 1 {} {0.183617654964 0.173834954377 0.155818835673} H3 18 0.0 1 14 {} {0.850098265398 0.308119848267 0.565189402513} Si12 19 0.0 1 14 {} {0.850145960558 0.384414895262 0.938375943912} Si13 20 0.0 1 14 {} {0.100123712261 0.309576096393 0.694489158715} Si14 21 0.0 1 14 {} {0.100846301225 0.388297047966 0.812242626278} Si15 22 0.0 1 14 {} {0.851836432589 0.537761458725 0.95126918629} Si16 23 0.0 1 14 {} {0.10333608206 0.543551592058 0.820934564941} Si17 24 0.0 1 14 {} {0.851186978243 0.464297668304 0.560854508603} Si18 25 0.0 1 14 {} {0.84605308934 0.229216670025 0.942607747326} Si19 26 0.0 1 14 {} {0.101430755401 0.467000757946 0.690710669903} Si20 27 0.0 1 14 {} {0.0963246028242 0.230440972746 0.814910965725} Si21 28 0.0 1 8 {} {0.363988541403 0.58919806932 0.047118168222} O5 29 0.0 1 1 {} {0.263462079095 0.594233693301 0.106757057901} H4 30 0.0 1 8 {} {0.110942453083 0.604483398801 0.779237381847} O6 31 0.0 1 1 {} {0.113992883648 0.62557479502 0.700410720314} H5 32 0.0 1 8 {} {0.334866948807 0.177701215714 0.0410982006596} O7 33 0.0 1 1 {} {0.933897843595 0.174001431115 0.100948923047} H6 34 0.0 1 8 {} {0.084963789808 0.179875185131 0.713942097335} O8 35 0.0 1 1 {} {0.184510475826 0.175995949651 0.654240063289} H7 36 0.0 1 14 {} {0.349484496095 0.307854995582 0.0626890708422} Si22 37 0.0 1 14 {} {0.350013277088 0.385538892619 0.44454016393} Si23 38 0.0 1 14 {} {0.599527179548 0.308028039324 0.192686107103} Si24 39 0.0 1 14 {} {0.600130178452 0.383988321332 0.318548360546} Si25 40 0.0 1 14 {} {0.354028802334 0.541277782567 0.434972827761} Si26 41 0.0 1 14 {} {0.609772107935 0.541092385519 0.310089226673} Si27 42 0.0 1 14 {} {0.353178114233 0.458684854496 0.0683501014928} Si28 43 0.0 1 14 {} {0.345589648842 0.229876836781 0.442160839079} Si29 44 0.0 1 14 {} {0.603305481631 0.460461362282 0.19750540271} Si30 45 0.0 1 14 {} {0.595781337522 0.229541504211 0.313885451473} Si31 46 0.0 1 8 {} {0.875581868599 0.590599834598 0.538962081601} O9 47 0.0 1 1 {} {0.947470385546 0.622752481014 0.528899303435} H8 48 0.0 1 8 {} {0.617461570669 0.591179505245 0.209356626569} O10 49 0.0 1 1 {} {0.514526444498 0.595686532955 0.15206711383} H9 50 0.0 1 8 {} {0.834672971938 0.178417867112 0.540793791081} O11 51 0.0 1 1 {} {0.434027721308 0.174782318076 0.600551791553} H10 52 0.0 1 8 {} {0.585008134739 0.177904101723 0.215832770718} O12 53 0.0 1 1 {} {0.684007206154 0.174320235905 0.155712022977} H11 54 0.0 1 14 {} {0.349203468201 0.308289348757 0.564359777767} Si32 55 0.0 1 14 {} {0.350549790785 0.384604407682 0.939518264996} Si33 56 0.0 1 14 {} {0.599206346327 0.308701314736 0.693538853654} Si34 57 0.0 1 14 {} {0.599864984463 0.386857369358 0.812249271391} Si35 58 0.0 1 14 {} {0.353549776054 0.536955329537 0.953664093628} Si36 59 0.0 1 14 {} {0.600261415185 0.541581908398 0.819328238585} Si37 60 0.0 1 14 {} {0.35131879972 0.464314027108 0.560574299169} Si38 61 0.0 1 14 {} {0.346230798344 0.229207331091 0.942780141967} Si39 62 0.0 1 14 {} {0.600791039239 0.465150683511 0.691079907031} Si40 63 0.0 1 14 {} {0.595991468137 0.229940800759 0.81459136915} Si41 64 0.0 1 8 {} {0.861141968104 0.590066271091 0.044740756171} O13 65 0.0 1 1 {} {0.761632556652 0.594786276683 0.105877101799} H12 66 0.0 1 8 {} {0.591933138668 0.597253535075 0.744872991039} O14 67 0.0 1 14 {} {0.587173518652 0.663065986187 0.746371796749} Si42 68 0.0 1 8 {} {0.834879028373 0.177688236655 0.0408918611802} O15 69 0.0 1 1 {} {0.433871559097 0.174153506205 0.101212843361} H13 70 0.0 1 8 {} {0.58489656539 0.179098438386 0.714383383674} O16 71 0.0 1 1 {} {0.684191669182 0.175495946596 0.654369921713} H14 72 0.0 1 7 {} {0.43985037227 0.688803127257 0.647454970592} N 73 0.0 1 1 {} {0.433630703708 0.75444016607 0.656468268248} H16 74 0.0 1 9 {} {0.782420795686 0.681608272552 0.717787218141} F4 75 0.0 1 9 {} {0.265821456885 0.683856524356 0.393753438094} F5 76 0.0 1 9 {} {0.54780980328 0.678597887868 0.88703157019} F3 77 0.0 1 9 {} {0.140158536317 0.660826560571 0.584412652724} F1 78 0.0 1 9 {} {0.437176784146 0.792253908183 0.658901170054} F2 79 0.0 1 9 {} {0.553775343179 0.659933545124 0.45118609628} 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