#MD System 2.0 @Title neb0_image02 @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 {} {0.848218973885 0.306923413896 0.0632146859005} Si1 1 0.0 1 14 {} {0.848517556435 0.385150430978 0.444827672245} Si2 2 0.0 1 14 {} {0.0980804881566 0.306873368831 0.193052316427} Si3 3 0.0 1 14 {} {0.0983092992157 0.3831389458 0.317886198755} Si4 4 0.0 1 14 {} {0.854675552821 0.540937257723 0.435602368662} Si5 5 0.0 1 14 {} {0.103146116991 0.537338608784 0.308169602874} Si6 6 0.0 1 14 {} {0.849957106483 0.458508179227 0.0647668229159} Si7 7 0.0 1 14 {} {0.844671322607 0.229109311445 0.442049950786} Si8 8 0.0 1 14 {} {0.0994522902431 0.458408135622 0.193072846292} Si9 9 0.0 1 14 {} {0.0946140414232 0.228394993876 0.314149798125} Si10 10 0.0 1 8 {} {0.358210857437 0.59246634302 0.51955891399} O1 11 0.0 1 14 {} {0.337657280404 0.656410624149 0.525072681302} Si11 12 0.0 1 8 {} {0.111530270576 0.589692637604 0.212397009923} O2 13 0.0 1 1 {} {0.0117912974939 0.593160722266 0.151986118973} H1 14 0.0 1 8 {} {0.333828572229 0.177742504567 0.541320443807} O3 15 0.0 1 1 {} {0.932965497804 0.17468658517 0.601764287058} H2 16 0.0 1 8 {} {0.0835812603121 0.176714303765 0.216013550871} O4 17 0.0 1 1 {} {0.18257206009 0.173275525667 0.155828491708} H3 18 0.0 1 14 {} {0.848456834077 0.307531749663 0.564460565885} Si12 19 0.0 1 14 {} {0.849152014486 0.38345479147 0.93906792582} Si13 20 0.0 1 14 {} {0.0985344214943 0.307866168739 0.693511799806} Si14 21 0.0 1 14 {} {0.099299592803 0.385982085957 0.812165879115} Si15 22 0.0 1 14 {} {0.850208159573 0.53724858143 0.948654774766} Si16 23 0.0 1 14 {} {0.100062187752 0.541189998763 0.823195750287} Si17 24 0.0 1 14 {} {0.850075991539 0.464031702054 0.562838763417} Si18 25 0.0 1 14 {} {0.844721963003 0.228337583136 0.942643844976} Si19 26 0.0 1 14 {} {0.0988679033171 0.464838110286 0.693226690271} Si20 27 0.0 1 14 {} {0.0947886181331 0.229157257244 0.814986708908} Si21 28 0.0 1 8 {} {0.361901516547 0.588720912227 0.0463720676521} O5 29 0.0 1 1 {} {0.261998062101 0.593373733464 0.106069350752} H4 30 0.0 1 8 {} {0.121173209101 0.597750083205 0.747695528263} O6 31 0.0 1 1 {} {0.0229891279045 0.62209327761 0.737678388398} H5 32 0.0 1 8 {} {0.333669851213 0.176707616201 0.0410541454502} O7 33 0.0 1 1 {} {0.932726625965 0.173361376915 0.101294426776} H6 34 0.0 1 8 {} {0.0838554214496 0.178225767275 0.714759914489} O8 35 0.0 1 1 {} {0.183205578445 0.174828431847 0.654691959431} H7 36 0.0 1 14 {} {0.348040852775 0.306891400327 0.0632488339514} Si22 37 0.0 1 14 {} {0.348500302008 0.385117963907 0.444635012781} Si23 38 0.0 1 14 {} {0.598116263403 0.306850213372 0.192888448174} Si24 39 0.0 1 14 {} {0.59872648791 0.383087662059 0.317768440343} Si25 40 0.0 1 14 {} {0.354913938887 0.538836211565 0.432453339527} Si26 41 0.0 1 14 {} {0.606143487119 0.537642725293 0.307965515909} Si27 42 0.0 1 14 {} {0.349643326769 0.458157240086 0.0661330149538} Si28 43 0.0 1 14 {} {0.344717660022 0.228989903335 0.441973017775} Si29 44 0.0 1 14 {} {0.600589219427 0.458553891162 0.193181573359} Si30 45 0.0 1 14 {} {0.594684618393 0.228430685174 0.314074661506} Si31 46 0.0 1 8 {} {0.848109253799 0.594880335402 0.522088982808} O9 47 0.0 1 1 {} {0.941765627266 0.621166759552 0.51948648344} H8 48 0.0 1 8 {} {0.613886605332 0.589528340442 0.211210199649} O10 49 0.0 1 1 {} {0.512840717677 0.593313514507 0.15187028371} H9 50 0.0 1 8 {} {0.833697878303 0.177937649157 0.54158213375} O11 51 0.0 1 1 {} {0.433000715042 0.174459986625 0.601549177595} H10 52 0.0 1 8 {} {0.583782501845 0.176745296125 0.215960304239} O12 53 0.0 1 1 {} {0.682718343907 0.17333198168 0.155722316217} H11 54 0.0 1 14 {} {0.348367952956 0.30746717919 0.564272678479} Si32 55 0.0 1 14 {} {0.349027672203 0.383441625819 0.939413749951} Si33 56 0.0 1 14 {} {0.598357798134 0.307717333853 0.693413117087} Si34 57 0.0 1 14 {} {0.598992104286 0.385615148049 0.812284989074} Si35 58 0.0 1 14 {} {0.347898604208 0.536559484648 0.950775001033} Si36 59 0.0 1 14 {} {0.597060633957 0.538697324055 0.825109766091} Si37 60 0.0 1 14 {} {0.348988832019 0.463578170468 0.563561997044} Si38 61 0.0 1 14 {} {0.344697796179 0.228312363145 0.942734265101} Si39 62 0.0 1 14 {} {0.59963942439 0.463863533788 0.69218341152} Si40 63 0.0 1 14 {} {0.594690619308 0.22911086313 0.814964162129} Si41 64 0.0 1 8 {} {0.861672914373 0.589528180755 0.0444071525666} O13 65 0.0 1 1 {} {0.761920725173 0.593646082034 0.104885221207} H12 66 0.0 1 8 {} {0.59370180476 0.593714694618 0.743487685671} O14 67 0.0 1 14 {} {0.600639050579 0.657877728193 0.742818713221} Si42 68 0.0 1 8 {} {0.833806068063 0.176754189726 0.0410154843719} O15 69 0.0 1 1 {} {0.432639078274 0.173298917341 0.101272951587} H13 70 0.0 1 8 {} {0.583741865993 0.178133715372 0.714893352691} O16 71 0.0 1 1 {} {0.683068880181 0.174813356329 0.654778848243} H14 72 0.0 1 7 {} {0.460233787542 0.682906293917 0.638124068735} N 73 0.0 1 1 {} {0.454597051416 0.724052661999 0.640628352573} H16 74 0.0 1 9 {} {0.801858182933 0.67380442561 0.721260527506} F4 75 0.0 1 9 {} {0.375623308547 0.680338050685 0.391811352696} F5 76 0.0 1 9 {} {0.560656437264 0.680711397031 0.877096319734} F3 77 0.0 1 9 {} {0.131961144923 0.669114866754 0.543121786484} F1 78 0.0 1 9 {} {0.438006237106 0.792246947529 0.65620397246} F2 79 0.0 1 9 {} {0.572849928495 0.781576887036 0.540838459209} 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 45 38 0 0 21 19 0 0 58 42 0 0 3 1 0 0 27 20 0 0 22 6 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 0 77 11 0 0 61 36 0 0 2 0 0 0 38 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 79 78 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 44 41 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 45 38 {0 0 0} 0 2 19 21 {1 0 0} 0 3 42 58 {0 0 -1} 0 4 3 1 {-1 0 0} 0 5 20 27 {0 0 0} 0 6 22 6 {0 0 1} 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 2 {1 0 0} 0 21 0 38 {0 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 68 33 {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 78 79 {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 41 44 {0 0 0} 0 84 70 71 {0 0 0} 0 85 16 9 {0 0 0} 0 86 2 9 {0 0 0} 0 87 69 32 {0 0 0} 0 88 39 37 {0 0 0} 0 89 22 64 {0 0 1} 0 90 27 34 {0 0 0} 0 91 20 18 {-1 0 0} 0 92 55 36 {0 0 1} 0 93 43 14 {0 0 0} 0 94 46 4 {0 0 0} 0 95 23 30 {0 0 0} 0 96 60 37 {0 0 0} 0 97 12 5 {0 0 0} 0 98 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