#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 {} {0.849560913049 0.307991232942 0.0625262755642} Si1 1 0.0 1 14 {} {0.850203997874 0.385315614776 0.444320923076} Si2 2 0.0 1 14 {} {0.0995112204829 0.307664801291 0.192501256633} Si3 3 0.0 1 14 {} {0.0996134069586 0.383620466845 0.317727979689} Si4 4 0.0 1 14 {} {0.85996875861 0.542856834617 0.439739955155} Si5 5 0.0 1 14 {} {0.10383979208 0.537852499378 0.305099245225} Si6 6 0.0 1 14 {} {0.847667851186 0.459048011104 0.0665368192647} Si7 7 0.0 1 14 {} {0.845903912203 0.230016461139 0.442227514081} Si8 8 0.0 1 14 {} {0.0994504223001 0.458696899615 0.192433227045} Si9 9 0.0 1 14 {} {0.0956542579516 0.229224655669 0.313634137881} Si10 10 0.0 1 8 {} {0.336470668767 0.592436669094 0.523069968032} O1 11 0.0 1 14 {} {0.349790088084 0.659547540638 0.518055289055} Si11 12 0.0 1 8 {} {0.113094645873 0.589474626024 0.208420791588} O2 13 0.0 1 1 {} {0.0128711175292 0.594372815558 0.149003806351} H1 14 0.0 1 8 {} {0.334862320888 0.178123866696 0.540313694226} O3 15 0.0 1 1 {} {0.933751599461 0.175327886304 0.600987108876} H2 16 0.0 1 8 {} {0.0845668858367 0.177486914559 0.215914835241} O4 17 0.0 1 1 {} {0.18357376873 0.173926007393 0.155796213139} H3 18 0.0 1 14 {} {0.850139159248 0.308248446498 0.565144431757} Si12 19 0.0 1 14 {} {0.849458129769 0.384673586348 0.938931806773} Si13 20 0.0 1 14 {} {0.0998432199089 0.309611556373 0.694686573792} Si14 21 0.0 1 14 {} {0.10059436107 0.388264753478 0.813141609273} Si15 22 0.0 1 14 {} {0.852458823785 0.537562038832 0.951026746843} Si16 23 0.0 1 14 {} {0.103624568201 0.543149339143 0.820720622305} Si17 24 0.0 1 14 {} {0.851206231218 0.46439172854 0.560155144179} Si18 25 0.0 1 14 {} {0.845956780242 0.229310362621 0.942557230065} Si19 26 0.0 1 14 {} {0.101273745592 0.46666446768 0.690327607322} Si20 27 0.0 1 14 {} {0.0961497325315 0.230508808285 0.814927740025} Si21 28 0.0 1 8 {} {0.363916605649 0.589446861137 0.0467592364367} O5 29 0.0 1 1 {} {0.263574162082 0.59415182844 0.106837767111} H4 30 0.0 1 8 {} {0.109366783316 0.604377114458 0.781241897887} O6 31 0.0 1 1 {} {0.109016997454 0.626196126392 0.703478526702} H5 32 0.0 1 8 {} {0.334853709144 0.177809805601 0.0410580607639} O7 33 0.0 1 1 {} {0.933877564403 0.174118994589 0.100990256185} H6 34 0.0 1 8 {} {0.0849660522612 0.179991518281 0.713834909331} O8 35 0.0 1 1 {} {0.184545235494 0.176087616145 0.654130677098} H7 36 0.0 1 14 {} {0.349596781339 0.308007399814 0.0626333900784} Si22 37 0.0 1 14 {} {0.350113159568 0.385068881359 0.443513339958} Si23 38 0.0 1 14 {} {0.599631241022 0.30820021161 0.192450989506} Si24 39 0.0 1 14 {} {0.600687609115 0.384094600087 0.318182439734} Si25 40 0.0 1 14 {} {0.352137374673 0.541183469284 0.435193232971} Si26 41 0.0 1 14 {} {0.607182744244 0.541864911179 0.311722989127} Si27 42 0.0 1 14 {} {0.353898973443 0.458921742424 0.0689565917834} Si28 43 0.0 1 14 {} {0.345511564758 0.22968947983 0.442074017194} Si29 44 0.0 1 14 {} {0.602527497025 0.461065885387 0.19925161101} Si30 45 0.0 1 14 {} {0.59579530119 0.22976074017 0.313870832924} Si31 46 0.0 1 8 {} {0.874436518439 0.591004611533 0.53980145977} O9 47 0.0 1 1 {} {0.951599358186 0.62205885669 0.532831146971} H8 48 0.0 1 8 {} {0.616672667595 0.591466652922 0.210004511313} O10 49 0.0 1 1 {} {0.515039444414 0.595599225711 0.151397671691} H9 50 0.0 1 8 {} {0.834604794635 0.178563951404 0.54074070749} O11 51 0.0 1 1 {} {0.433882867113 0.174726451283 0.600564515533} H10 52 0.0 1 8 {} {0.585028702458 0.178116480026 0.21587942663} O12 53 0.0 1 1 {} {0.684004485057 0.174469084474 0.155751975791} H11 54 0.0 1 14 {} {0.349101746891 0.307971845109 0.564773202423} Si32 55 0.0 1 14 {} {0.351160664009 0.384883596821 0.939734341493} Si33 56 0.0 1 14 {} {0.599452264864 0.308750231371 0.693559200985} Si34 57 0.0 1 14 {} {0.60016786345 0.386864234091 0.812212941866} Si35 58 0.0 1 14 {} {0.353946483821 0.53713557068 0.953488521094} Si36 59 0.0 1 14 {} {0.600979580882 0.541689129762 0.818742835121} Si37 60 0.0 1 14 {} {0.351598827711 0.464117164891 0.560303939724} Si38 61 0.0 1 14 {} {0.346206232587 0.229302930526 0.942688402434} Si39 62 0.0 1 14 {} {0.601467586507 0.465004268277 0.690804575689} Si40 63 0.0 1 14 {} {0.595992585531 0.230012898763 0.81460210053} Si41 64 0.0 1 8 {} {0.861465508639 0.590099057246 0.0438643049268} O13 65 0.0 1 1 {} {0.762858562563 0.594561063777 0.105625039222} H12 66 0.0 1 8 {} {0.595941473616 0.597141366769 0.743824308896} O14 67 0.0 1 14 {} {0.589828964518 0.662748628754 0.744337742455} Si42 68 0.0 1 8 {} {0.834867066061 0.177807279968 0.040893730543} O15 69 0.0 1 1 {} {0.433850866828 0.174286887591 0.10120896645} H13 70 0.0 1 8 {} {0.58475494322 0.179223804898 0.714277329273} O16 71 0.0 1 1 {} {0.684100580018 0.175652567798 0.654265164935} H14 72 0.0 1 7 {} {0.443926186603 0.68887160812 0.645362201505} N 73 0.0 1 1 {} {0.440003471803 0.752354507649 0.650738350074} H16 74 0.0 1 9 {} {0.786560168809 0.680476914405 0.720261067125} F4 75 0.0 1 9 {} {0.264945842508 0.68222049373 0.392383752339} F5 76 0.0 1 9 {} {0.544332840777 0.679607336656 0.88265010844} F3 77 0.0 1 9 {} {0.140766830597 0.662494446007 0.586204991162} F1 78 0.0 1 9 {} {0.436286497436 0.791081771872 0.660536892943} F2 79 0.0 1 9 {} {0.553950472055 0.658663300675 0.453826605833} 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