#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 {} {0.849608075774 0.307940527821 0.0625710690378} Si1 1 0.0 1 14 {} {0.850228878742 0.385261478245 0.444364846971} Si2 2 0.0 1 14 {} {0.0995400571797 0.307640334859 0.192575354512} Si3 3 0.0 1 14 {} {0.0997521240675 0.383590227288 0.317839769814} Si4 4 0.0 1 14 {} {0.860289650435 0.542725434122 0.439574638352} Si5 5 0.0 1 14 {} {0.104180870344 0.537919324887 0.305096301581} Si6 6 0.0 1 14 {} {0.848354449624 0.458949917635 0.0662889763067} Si7 7 0.0 1 14 {} {0.845903630262 0.229980671504 0.4422533461} Si8 8 0.0 1 14 {} {0.0996532200409 0.458724080997 0.192744362143} Si9 9 0.0 1 14 {} {0.0956476674812 0.229199501104 0.313639499366} Si10 10 0.0 1 8 {} {0.336859708767 0.591945614207 0.524290885677} O1 11 0.0 1 14 {} {0.351302279986 0.659135558386 0.51758513117} Si11 12 0.0 1 8 {} {0.112986128724 0.589493616178 0.208386186808} O2 13 0.0 1 1 {} {0.0126262916235 0.594320160614 0.149006302535} H1 14 0.0 1 8 {} {0.334884221665 0.178181679912 0.540360982608} O3 15 0.0 1 1 {} {0.933768634248 0.175301490104 0.600999277723} H2 16 0.0 1 8 {} {0.0845887379872 0.177462913375 0.215919094711} O4 17 0.0 1 1 {} {0.183585950935 0.173895699377 0.155798305985} H3 18 0.0 1 14 {} {0.85011273495 0.30820334582 0.565173651118} Si12 19 0.0 1 14 {} {0.849652236635 0.384574261366 0.938789805938} Si13 20 0.0 1 14 {} {0.0999192714172 0.309592797487 0.694632074532} Si14 21 0.0 1 14 {} {0.100698628905 0.388283985264 0.812910858095} Si15 22 0.0 1 14 {} {0.852269651964 0.537631925817 0.951095194828} Si16 23 0.0 1 14 {} {0.103457319002 0.543385359189 0.820657773918} Si17 24 0.0 1 14 {} {0.851207533552 0.464309995772 0.560473517856} Si18 25 0.0 1 14 {} {0.845971233554 0.229284373485 0.942575804929} Si19 26 0.0 1 14 {} {0.101325873876 0.466825384336 0.690497214418} Si20 27 0.0 1 14 {} {0.0961848332106 0.230477372512 0.814950785972} Si21 28 0.0 1 8 {} {0.364033054941 0.589357641718 0.0468485406254} O5 29 0.0 1 1 {} {0.263607141604 0.594173812184 0.106797864074} H4 30 0.0 1 8 {} {0.10971399959 0.604369262379 0.780575724391} O6 31 0.0 1 1 {} {0.110664096713 0.625969908216 0.702709735492} H5 32 0.0 1 8 {} {0.334861736381 0.177782217175 0.0410652983271} O7 33 0.0 1 1 {} {0.933885116589 0.174083435648 0.100978524624} H6 34 0.0 1 8 {} {0.0849669804615 0.179958357939 0.713868937623} O8 35 0.0 1 1 {} {0.184530163567 0.176052284436 0.654159675142} H7 36 0.0 1 14 {} {0.349552556587 0.307974363353 0.0626595116788} Si22 37 0.0 1 14 {} {0.350035856442 0.385335430911 0.443939103124} Si23 38 0.0 1 14 {} {0.599605419937 0.308123734374 0.192495132605} Si24 39 0.0 1 14 {} {0.60049818503 0.384022007002 0.318296717756} Si25 40 0.0 1 14 {} {0.352874307395 0.541149250084 0.434755594867} Si26 41 0.0 1 14 {} {0.608041276764 0.541629580487 0.311114373573} Si27 42 0.0 1 14 {} {0.353573097612 0.458838336437 0.0687434686695} Si28 43 0.0 1 14 {} {0.345537279444 0.22974097237 0.442095893371} Si29 44 0.0 1 14 {} {0.602683106077 0.460817812061 0.198637984583} Si30 45 0.0 1 14 {} {0.595807195468 0.229696716566 0.313873412734} Si31 46 0.0 1 8 {} {0.875064166059 0.590893999912 0.539565631132} O9 47 0.0 1 1 {} {0.950427278309 0.622311747448 0.53162061227} H8 48 0.0 1 8 {} {0.616882714088 0.591370128978 0.209844876891} O10 49 0.0 1 1 {} {0.514828227743 0.595624723349 0.151694672853} H9 50 0.0 1 8 {} {0.834623194557 0.178524456526 0.540759397593} O11 51 0.0 1 1 {} {0.433930431516 0.174730903241 0.600565058371} H10 52 0.0 1 8 {} {0.585017883953 0.17805988551 0.215854957399} O12 53 0.0 1 1 {} {0.684011470638 0.174427999765 0.155741093551} H11 54 0.0 1 14 {} {0.349126312541 0.308098943072 0.564623270896} Si32 55 0.0 1 14 {} {0.350950140216 0.384803299481 0.939694719398} Si33 56 0.0 1 14 {} {0.599373988226 0.308724403947 0.693567073062} Si34 57 0.0 1 14 {} {0.600041396029 0.386825757483 0.812301198684} Si35 58 0.0 1 14 {} {0.353791377366 0.537099261975 0.953448104142} Si36 59 0.0 1 14 {} {0.600832246018 0.54166958398 0.818843014946} Si37 60 0.0 1 14 {} {0.351479748853 0.464304829433 0.5602857337} Si38 61 0.0 1 14 {} {0.346222281806 0.229279976893 0.9427156907} Si39 62 0.0 1 14 {} {0.601201679652 0.465061037093 0.690872072223} Si40 63 0.0 1 14 {} {0.595995899895 0.229988859313 0.814602419344} Si41 64 0.0 1 8 {} {0.861359325626 0.590064979029 0.0441869264132} O13 65 0.0 1 1 {} {0.762428693305 0.594657310343 0.105693591639} H12 66 0.0 1 8 {} {0.594844541998 0.597202997063 0.744176389615} O14 67 0.0 1 14 {} {0.588517331788 0.662933582029 0.745130905589} Si42 68 0.0 1 8 {} {0.834873943691 0.177778584564 0.0408948471722} O15 69 0.0 1 1 {} {0.433855501964 0.174247264389 0.101212744798} H13 70 0.0 1 8 {} {0.584798124853 0.179189018697 0.714305787065} O16 71 0.0 1 1 {} {0.684123113569 0.175602483972 0.654287989856} H14 72 0.0 1 7 {} {0.443384517201 0.689002291099 0.645628671292} N 73 0.0 1 1 {} {0.43804007362 0.752711420324 0.65295491144} H16 74 0.0 1 9 {} {0.78472263497 0.680741392578 0.719443115159} F4 75 0.0 1 9 {} {0.266254037941 0.682866628 0.392485473135} F5 76 0.0 1 9 {} {0.54577639121 0.679243540429 0.884383372133} F3 77 0.0 1 9 {} {0.141003902033 0.661946279524 0.585665524545} F1 78 0.0 1 9 {} {0.436680382232 0.791710833093 0.659763130198} F2 79 0.0 1 9 {} {0.552549263703 0.659423739431 0.452771896104} 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