#MD System 2.0

@Title Kainite_XRD_1.cif_P1 (1 0 0)  surface

@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
12 {} {0.749999999999 0.5 0.51614927537} Mg1 1 0.0 -1
12 {} {0.249999999999 0 0.51614927537} Mg2 2 0.0 -1
12 {} {0.496049978466 0.250200563722 0.517090943634} Mg3 3 0.0 -1
12 {} {0.496049978466 0.749799436278 0.517090943634} Mg4 4 0.0 -1
16 {} {0.743969120723 0.328855138263 0.571255295338} S1 5 0.0 -1
16 {} {0.743969120723 0.671144861737 0.571255295338} S2 6 0.0 -1
16 {} {0.23784901521 0.171077063166 0.572069894359} S3 7 0.0 -1
16 {} {0.23784901521 0.828922936834 0.572069894359} S4 8 0.0 -1
8 {} {0.153221787764 0.240357169042 0.556242173779} O1 9 0.0 -1
8 {} {0.153221787764 0.759642830958 0.556242173779} O2 10 0.0 -1
8 {} {0.656749397487 0.259698547683 0.556935485517} O3 11 0.0 -1
8 {} {0.656749397487 0.740301452317 0.556935485517} O4 12 0.0 -1
8 {} {0.889977563494 0.317473705306 0.55834438571} O5 13 0.0 -1
8 {} {0.889977563494 0.682526294694 0.55834438571} O6 14 0.0 -1
8 {} {0.687889154157 0.410532353906 0.556731577927} O7 15 0.0 -1
8 {} {0.687889154157 0.589467646094 0.556731577927} O8 16 0.0 -1
8 {} {0.184329460767 0.090125885395 0.555584163693} O9 17 0.0 -1
8 {} {0.184329460767 0.909874114605 0.555584163693} O10 18 0.0 -1
8 {} {0.386753366685 0.183611642019 0.560447873909} O11 19 0.0 -1
8 {} {0.386753366685 0.816388357981 0.560447873909} O12 20 0.0 -1
8 {} {0.737097071135 0.333272601808 0.614447552985} O13 21 0.0 -1
8 {} {0.737097071135 0.666727398192 0.614447552985} O14 22 0.0 -1
8 {} {0.222963517883 0.167740108407 0.614551889537} O15 23 0.0 -1
8 {} {0.222963517883 0.832259891593 0.614551889537} O16 24 0.0 -1
8 {} {0.44376712351 0 0.542400461608} O17 25 0.0 -1
8 {} {0.420092434812 0.36382930478 0.53601890676} O18 26 0.0 -1
8 {} {0.420092434812 0.63617069522 0.53601890676} O19 27 0.0 -1
8 {} {0.913701397668 0.137808181322 0.532300733361} O20 28 0.0 -1
8 {} {0.913701397668 0.862191818678 0.532300733361} O21 29 0.0 -1
1 {} {0.452130118415 0 0.570783298077} H1 30 0.0 -1
1 {} {0.538349343846 0 0.531988752418} H2 31 0.0 -1
1 {} {0.36654543838 0.361709212963 0.56072705913} H5 32 0.0 -1
1 {} {0.36654543838 0.638290787037 0.56072705913} H6 33 0.0 -1
1 {} {0.50809334546 0.391175806969 0.543373616607} H7 34 0.0 -1
1 {} {0.50809334546 0.608824193031 0.543373616607} H8 35 0.0 -1
1 {} {0.831932598605 0.136171395842 0.54937802056} H9 36 0.0 -1
1 {} {0.831932598605 0.863828604158 0.54937802056} H10 37 0.0 -1
1 {} {0.987416083899 0.105716947327 0.545111552402} H11 38 0.0 -1
1 {} {0.987416083899 0.894283052673 0.545111552402} H12 39 0.0 -1
19 {} {0.870975688597 0.5 0.054583755967} K1 40 0.0 -1
19 {} {0.489779098557 0.5 0.120189929943} K2 41 0.0 -1
19 {} {0.582096995715 0.807465176288 0.11769008431} K3 42 0.0 -1
19 {} {0.582096995715 0.192534823712 0.11769008431} K4 43 0.0 -1
12 {} {0.937499999999 0.75 0.0863873188445} Mg5 44 0.0 -1
12 {} {0.937499999999 0.25 0.0863873188445} Mg6 45 0.0 -1
12 {} {0.128950021533 0.750200563722 0.22869963608} Mg7 46 0.0 -1
12 {} {0.128950021533 0.249799436278 0.22869963608} Mg8 47 0.0 -1
16 {} {0.881030879276 0.828855138263 0.174535284381} S5 48 0.0 -1
16 {} {0.881030879276 0.171144861737 0.174535284381} S6 49 0.0 -1
16 {} {0.387150984789 0.671077063166 0.173720685358} S7 50 0.0 -1
16 {} {0.387150984789 0.328922936834 0.173720685358} S8 51 0.0 -1
17 {} {0.153838283047 0.5 0.110302495691} Cl4 52 0.0 -1
17 {} {0.800552108073 0.5 0.148219422029} Cl5 53 0.0 -1
17 {} {0.287615733265 0.888710208363 0.124889849652} Cl6 54 0.0 -1
17 {} {0.287615733265 0.111289791637 0.124889849652} Cl7 55 0.0 -1
8 {} {0.471778212235 0.740357169042 0.189548405938} O22 56 0.0 -1
8 {} {0.471778212235 0.259642830958 0.189548405938} O23 57 0.0 -1
8 {} {0.968250602512 0.759698547683 0.188855094198} O24 58 0.0 -1
8 {} {0.968250602512 0.240301452317 0.188855094198} O25 59 0.0 -1
8 {} {0.735022436504 0.817473705306 0.187446194007} O26 60 0.0 -1
8 {} {0.735022436504 0.182526294694 0.187446194007} O27 61 0.0 -1
8 {} {0.937110845841 0.910532353906 0.18905900179} O28 62 0.0 -1
8 {} {0.937110845841 0.089467646094 0.18905900179} O29 63 0.0 -1
8 {} {0.440670539232 0.590125885395 0.190206416027} O30 64 0.0 -1
8 {} {0.440670539232 0.409874114605 0.190206416027} O31 65 0.0 -1
8 {} {0.238246633313 0.683611642019 0.185342705811} O32 66 0.0 -1
8 {} {0.238246633313 0.316388357981 0.185342705811} O33 67 0.0 -1
8 {} {0.887902928864 0.833272601808 0.131343026734} O34 68 0.0 -1
8 {} {0.887902928864 0.166727398192 0.131343026734} O35 69 0.0 -1
8 {} {0.402036482116 0.667740108407 0.131238690183} O36 70 0.0 -1
8 {} {0.402036482116 0.332259891593 0.131238690183} O37 71 0.0 -1
8 {} {0.181232876489 0.5 0.203390118112} O38 72 0.0 -1
8 {} {0.783005952658 0.671202390551 0.107254096568} O39 73 0.0 -1
8 {} {0.783005952658 0.328797609449 0.107254096568} O40 74 0.0 -1
8 {} {0.204907565187 0.86382930478 0.209771672957} O41 75 0.0 -1
8 {} {0.204907565187 0.13617069522 0.209771672957} O42 76 0.0 -1
8 {} {0.71129860233 0.637808181322 0.213489846356} O43 77 0.0 -1
8 {} {0.71129860233 0.362191818678 0.213489846356} O44 78 0.0 -1
8 {} {0.0854805371317 0.686458909232 0.116813879059} O45 79 0.0 -1
8 {} {0.0854805371317 0.313541090768 0.116813879059} O46 80 0.0 -1
8 {} {0.301354508228 0.5 0.0331449321648} O47 81 0.0 -1
1 {} {0.172869881583 0.5 0.175007281643} H15 82 0.0 -1
1 {} {0.0866506561529 0.5 0.213801827302} H16 83 0.0 -1
1 {} {0.714137458325 0.652908632703 0.0872839677181} H17 84 0.0 -1
1 {} {0.714137458325 0.347091367297 0.0872839677181} H18 85 0.0 -1
1 {} {0.800203200854 0.620872400554 0.123159418582} H19 86 0.0 -1
1 {} {0.800203200854 0.379127599446 0.123159418582} H20 87 0.0 -1
1 {} {0.258454561618 0.861709212963 0.18506352059} H21 88 0.0 -1
1 {} {0.258454561618 0.138290787037 0.18506352059} H22 89 0.0 -1
1 {} {0.116906654539 0.891175806969 0.202416963113} H23 90 0.0 -1
1 {} {0.116906654539 0.108824193031 0.202416963113} H24 91 0.0 -1
1 {} {0.793067401393 0.636171395842 0.19641255916} H25 92 0.0 -1
1 {} {0.793067401393 0.363828604158 0.19641255916} H26 93 0.0 -1
1 {} {0.6375839161 0.605716947327 0.200679027317} H27 94 0.0 -1
1 {} {0.6375839161 0.394283052673 0.200679027317} H28 95 0.0 -1
1 {} {0.0951679984734 0.625306055942 0.114340106545} H29 96 0.0 -1
1 {} {0.0951679984734 0.374693944058 0.114340106545} H30 97 0.0 -1
1 {} {0.125139532148 0.69906724805 0.142395827531} H31 98 0.0 -1
1 {} {0.125139532148 0.30093275195 0.142395827531} H32 99 0.0 -1
1 {} {0.259443423736 0.5 0.0596257527869} H33 100 0.0 -1
1 {} {0.403156104281 0.5 0.0351912194708} H34 101 0.0 -1
19 {} {0.00402431140247 0 0.118190881719} K5 102 0.0 -1
19 {} {0.745975688597 0 0.341091726981} K6 103 0.0 -1
19 {} {0.879024311402 0.5 0.404698852736} K7 104 0.0 -1
19 {} {0.364779098557 0 0.406697900957} K8 105 0.0 -1
19 {} {0.385220901442 0 0.0525847077486} K9 106 0.0 -1
19 {} {0.260220901442 0.5 0.339092678763} K10 107 0.0 -1
19 {} {0.457096995715 0.307465176288 0.404198055324} K11 108 0.0 -1
19 {} {0.457096995715 0.692534823712 0.404198055324} K12 109 0.0 -1
19 {} {0.292903004284 0.307465176288 0.0550845533813} K13 110 0.0 -1
19 {} {0.292903004284 0.692534823712 0.0550845533813} K14 111 0.0 -1
19 {} {0.167903004284 0.807465176288 0.341592524395} K15 112 0.0 -1
19 {} {0.167903004284 0.192534823712 0.341592524395} K16 113 0.0 -1
12 {} {0.874999999999 0 0.22964130435} Mg9 114 0.0 -1
12 {} {0.374999999999 0.5 0.22964130435} Mg10 115 0.0 -1
12 {} {0.812499999999 0.25 0.372895289859} Mg11 116 0.0 -1
12 {} {0.812499999999 0.75 0.372895289859} Mg12 117 0.0 -1
12 {} {0.00395002153345 0.250200563722 0.5152076071} Mg13 118 0.0 -1
12 {} {0.00395002153345 0.749799436278 0.5152076071} Mg14 119 0.0 -1
12 {} {0.621049978466 0.750200563722 0.23058297262} Mg15 120 0.0 -1
12 {} {0.621049978466 0.249799436278 0.23058297262} Mg16 121 0.0 -1
16 {} {0.756030879276 0.328855138263 0.461043255395} S9 122 0.0 -1
16 {} {0.756030879276 0.671144861737 0.461043255395} S10 123 0.0 -1
16 {} {0.868969120723 0.828855138263 0.284747324324} S11 124 0.0 -1
16 {} {0.868969120723 0.171144861737 0.284747324324} S12 125 0.0 -1
16 {} {0.262150984789 0.171077063166 0.460228656372} S13 126 0.0 -1
16 {} {0.262150984789 0.828922936834 0.460228656372} S14 127 0.0 -1
16 {} {0.36284901521 0.671077063166 0.285561923345} S15 128 0.0 -1
16 {} {0.36284901521 0.328922936834 0.285561923345} S16 129 0.0 -1
17 {} {0.0288382830465 0 0.396810466705} Cl8 130 0.0 -1
17 {} {0.721161716952 0 0.0624721419955} Cl9 131 0.0 -1
17 {} {0.596161716952 0.5 0.348980113015} Cl10 132 0.0 -1
17 {} {0.675552108073 0 0.434727393044} Cl11 133 0.0 -1
17 {} {0.0744478919259 0 0.0245552156623} Cl12 134 0.0 -1
17 {} {0.949447891925 0.5 0.311063186676} Cl13 135 0.0 -1
17 {} {0.162615733265 0.388710208363 0.411397820666} Cl14 136 0.0 -1
17 {} {0.162615733265 0.611289791637 0.411397820666} Cl15 137 0.0 -1
17 {} {0.587384266734 0.388710208363 0.0478847880367} Cl16 138 0.0 -1
17 {} {0.587384266734 0.611289791637 0.0478847880367} Cl17 139 0.0 -1
17 {} {0.462384266734 0.888710208363 0.334392759054} Cl18 140 0.0 -1
17 {} {0.462384266734 0.111289791637 0.334392759054} Cl19 141 0.0 -1
8 {} {0.346778212235 0.240357169042 0.476056376952} O48 142 0.0 -1
8 {} {0.346778212235 0.759642830958 0.476056376952} O49 143 0.0 -1
8 {} {0.278221787764 0.740357169042 0.269734202767} O50 144 0.0 -1
8 {} {0.278221787764 0.259642830958 0.269734202767} O51 145 0.0 -1
8 {} {0.843250602512 0.259698547683 0.475363065217} O52 146 0.0 -1
8 {} {0.843250602512 0.740301452317 0.475363065217} O53 147 0.0 -1
8 {} {0.781749397487 0.759698547683 0.270427514502} O54 148 0.0 -1
8 {} {0.781749397487 0.240301452317 0.270427514502} O55 149 0.0 -1
8 {} {0.610022436504 0.317473705306 0.473954165021} O56 150 0.0 -1
8 {} {0.610022436504 0.682526294694 0.473954165021} O57 151 0.0 -1
8 {} {0.0149775634945 0.817473705306 0.271836414696} O58 152 0.0 -1
8 {} {0.0149775634945 0.182526294694 0.271836414696} O59 153 0.0 -1
8 {} {0.812110845841 0.410532353906 0.47556697281} O60 154 0.0 -1
8 {} {0.812110845841 0.589467646094 0.47556697281} O61 155 0.0 -1
8 {} {0.812889154157 0.910532353906 0.27022360691} O62 156 0.0 -1
8 {} {0.812889154157 0.089467646094 0.27022360691} O63 157 0.0 -1
8 {} {0.315670539232 0.090125885395 0.476714387041} O64 158 0.0 -1
8 {} {0.315670539232 0.909874114605 0.476714387041} O65 159 0.0 -1
8 {} {0.309329460767 0.590125885395 0.269076192674} O66 160 0.0 -1
8 {} {0.309329460767 0.409874114605 0.269076192674} O67 161 0.0 -1
8 {} {0.113246633314 0.183611642019 0.471850676825} O68 162 0.0 -1
8 {} {0.113246633314 0.816388357981 0.471850676825} O69 163 0.0 -1
8 {} {0.511753366685 0.683611642019 0.273939902895} O70 164 0.0 -1
8 {} {0.511753366685 0.316388357981 0.273939902895} O71 165 0.0 -1
8 {} {0.762902928864 0.333272601808 0.417850997749} O72 166 0.0 -1
8 {} {0.762902928864 0.666727398192 0.417850997749} O73 167 0.0 -1
8 {} {0.862097071135 0.833272601808 0.327939581971} O76 168 0.0 -1
8 {} {0.862097071135 0.166727398192 0.327939581971} O77 169 0.0 -1
8 {} {0.277036482116 0.167740108407 0.417746661195} O78 170 0.0 -1
8 {} {0.277036482116 0.832259891593 0.417746661195} O79 171 0.0 -1
8 {} {0.347963517883 0.667740108407 0.328043918523} O82 172 0.0 -1
8 {} {0.347963517883 0.332259891593 0.328043918523} O83 173 0.0 -1
8 {} {0.0562328764894 0 0.489898089124} O84 174 0.0 -1
8 {} {0.56876712351 0.5 0.255892490591} O85 175 0.0 -1
8 {} {0.67791487693 0 0.209038112487} O86 176 0.0 -1
8 {} {0.0720851230694 0 0.250244496219} O87 177 0.0 -1
8 {} {0.55291487693 0.5 0.495546083499} O88 178 0.0 -1
8 {} {0.947085123069 0.5 0.536752467233} O89 179 0.0 -1
8 {} {0.658005952658 0.171202390551 0.393762067585} O90 180 0.0 -1
8 {} {0.658005952658 0.828797609449 0.393762067585} O91 181 0.0 -1
8 {} {0.0919940473409 0.171202390551 0.0655205411212} O92 182 0.0 -1
8 {} {0.0919940473409 0.828797609449 0.0655205411212} O93 183 0.0 -1
8 {} {0.96699404734 0.671202390551 0.352028512135} O94 184 0.0 -1
8 {} {0.96699404734 0.328797609449 0.352028512135} O95 185 0.0 -1
8 {} {0.0799075651871 0.36382930478 0.496279643971} O96 186 0.0 -1
8 {} {0.0799075651871 0.63617069522 0.496279643971} O97 187 0.0 -1
8 {} {0.545092434812 0.86382930478 0.249510935746} O98 188 0.0 -1
8 {} {0.545092434812 0.13617069522 0.249510935746} O99 189 0.0 -1
8 {} {0.58629860233 0.137808181322 0.49999781737} O100 190 0.0 -1
8 {} {0.58629860233 0.862191818678 0.49999781737} O101 191 0.0 -1
8 {} {0.0387013976685 0.637808181322 0.245792762347} O102 192 0.0 -1
8 {} {0.0387013976685 0.362191818678 0.245792762347} O103 193 0.0 -1
8 {} {0.960480537131 0.186458909232 0.403321850079} O104 194 0.0 -1
8 {} {0.960480537131 0.813541090768 0.403321850079} O105 195 0.0 -1
8 {} {0.789519462868 0.186458909232 0.0559607586268} O106 196 0.0 -1
8 {} {0.789519462868 0.813541090768 0.0559607586268} O107 197 0.0 -1
8 {} {0.664519462868 0.686458909232 0.342468729641} O108 198 0.0 -1
8 {} {0.664519462868 0.313541090768 0.342468729641} O109 199 0.0 -1
8 {} {0.573645491771 0 0.139629705521} O110 200 0.0 -1
8 {} {0.176354508228 0 0.319652903182} O111 201 0.0 -1
8 {} {0.448645491771 0.5 0.426137676536} O112 202 0.0 -1
1 {} {0.0478698815834 0 0.461515252657} H35 203 0.0 -1
1 {} {0.577130118415 0.5 0.284275327063} H36 204 0.0 -1
1 {} {0.961650656152 0 0.500309798316} H37 205 0.0 -1
1 {} {0.663349343846 0.5 0.245480781404} H38 206 0.0 -1
1 {} {0.647903148031 0 0.18141220722} H39 207 0.0 -1
1 {} {0.102096851968 0 0.277870401483} H40 208 0.0 -1
1 {} {0.522903148031 0.5 0.467920178234} H41 209 0.0 -1
1 {} {0.977096851968 0.5 0.564378372497} H42 210 0.0 -1
1 {} {0.591208634998 0 0.223916149366} H43 211 0.0 -1
1 {} {0.158791365001 0 0.235366459334} H44 212 0.0 -1
1 {} {0.466208634998 0.5 0.510424120383} H45 213 0.0 -1
1 {} {0.0337913650014 0.5 0.521874430349} H46 214 0.0 -1
1 {} {0.589137458325 0.152908632703 0.373791938732} H47 215 0.0 -1
1 {} {0.589137458325 0.847091367297 0.373791938732} H48 216 0.0 -1
1 {} {0.160862541673 0.152908632703 0.0854906699709} H49 217 0.0 -1
1 {} {0.160862541673 0.847091367297 0.0854906699709} H50 218 0.0 -1
1 {} {0.0358625416735 0.652908632703 0.371998640988} H51 219 0.0 -1
1 {} {0.0358625416735 0.347091367297 0.371998640988} H52 220 0.0 -1
1 {} {0.675203200854 0.120872400554 0.409667389602} H53 221 0.0 -1
1 {} {0.675203200854 0.879127599446 0.409667389602} H54 222 0.0 -1
1 {} {0.0747967991454 0.120872400554 0.0496152191042} H55 223 0.0 -1
1 {} {0.0747967991454 0.879127599446 0.0496152191042} H56 224 0.0 -1
1 {} {0.949796799145 0.620872400554 0.336123190118} H57 225 0.0 -1
1 {} {0.949796799145 0.379127599446 0.336123190118} H58 226 0.0 -1
1 {} {0.133454561619 0.361709212963 0.471571491604} H59 227 0.0 -1
1 {} {0.133454561619 0.638290787037 0.471571491604} H60 228 0.0 -1
1 {} {0.49154543838 0.861709212963 0.274219088113} H61 229 0.0 -1
1 {} {0.49154543838 0.138290787037 0.274219088113} H62 230 0.0 -1
1 {} {0.991906654539 0.391175806969 0.488924934127} H63 231 0.0 -1
1 {} {0.991906654539 0.608824193031 0.488924934127} H64 232 0.0 -1
1 {} {0.63309334546 0.891175806969 0.256865645592} H65 233 0.0 -1
1 {} {0.63309334546 0.108824193031 0.256865645592} H66 234 0.0 -1
1 {} {0.668067401393 0.136171395842 0.482920530174} H67 235 0.0 -1
1 {} {0.668067401393 0.863828604158 0.482920530174} H68 236 0.0 -1
1 {} {0.956932598605 0.636171395842 0.262870049546} H69 237 0.0 -1
1 {} {0.956932598605 0.363828604158 0.262870049546} H70 238 0.0 -1
1 {} {0.5125839161 0.105716947327 0.487186998332} H71 239 0.0 -1
1 {} {0.5125839161 0.894283052673 0.487186998332} H72 240 0.0 -1
1 {} {0.112416083899 0.605716947327 0.258603581388} H73 241 0.0 -1
1 {} {0.112416083899 0.394283052673 0.258603581388} H74 242 0.0 -1
1 {} {0.970167998473 0.125306055942 0.400848077559} H75 243 0.0 -1
1 {} {0.970167998473 0.874693944058 0.400848077559} H76 244 0.0 -1
1 {} {0.779832001526 0.125306055942 0.0584345311415} H77 245 0.0 -1
1 {} {0.779832001526 0.874693944058 0.0584345311415} H78 246 0.0 -1
1 {} {0.654832001526 0.625306055942 0.344942502156} H79 247 0.0 -1
1 {} {0.654832001526 0.374693944058 0.344942502156} H80 248 0.0 -1
1 {} {0.000139532147452 0.19906724805 0.428903798551} H81 249 0.0 -1
1 {} {0.000139532147452 0.80093275195 0.428903798551} H82 250 0.0 -1
1 {} {0.749860467852 0.19906724805 0.0303788101552} H83 251 0.0 -1
1 {} {0.749860467852 0.80093275195 0.0303788101552} H84 252 0.0 -1
1 {} {0.624860467852 0.69906724805 0.316886781169} H85 253 0.0 -1
1 {} {0.624860467852 0.30093275195 0.316886781169} H86 254 0.0 -1
1 {} {0.615556576262 0 0.113148884899} H87 255 0.0 -1
1 {} {0.134443423737 0 0.346133723801} H88 256 0.0 -1
1 {} {0.490556576262 0.5 0.399656855913} H89 257 0.0 -1
1 {} {0.471843895718 0 0.137583418221} H90 258 0.0 -1
1 {} {0.278156104281 0 0.321699190485} H91 259 0.0 -1
1 {} {0.346843895718 0.5 0.424091389235} H92 260 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} {9.60183 16.0556 34.5 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{9.60183 0 0} {0 16.0556 0} {0 0 34.5}} {{0.10414681368 0 0} {0 0.062283564613 0} {0 0 0.0289855072464}}
@end
@Columns AsymmetricBond
	Atom1	reference	AsymmetricAtom
	Atom2	reference	AsymmetricAtom
	Key	int	0
	Order	int	0
@end
@data
153 0 0 0
154 0 0 0
177 0 0 0
14 0 0 0
15 0 0 0
178 0 0 0
158 1 0 0
157 1 0 0
173 1 0 0
17 1 0 0
16 1 0 0
24 1 0 0
141 2 0 0
149 2 0 0
189 2 0 0
18 2 0 0
10 2 0 0
25 2 0 0
142 3 0 0
150 3 0 0
190 3 0 0
26 3 0 0
19 3 0 0
11 3 0 0
10 4 0 0
12 4 0 0
20 4 0 2
14 4 0 0
15 5 0 0
11 5 0 0
13 5 0 0
21 5 0 2
8 6 0 0
16 6 0 0
18 6 0 0
22 6 0 2
9 7 0 0
17 7 0 0
19 7 0 0
23 7 0 2
117 8 0 0
118 9 0 0
117 12 0 0
118 13 0 0
29 24 0 0
30 24 0 0
31 25 0 0
33 25 0 0
32 26 0 0
34 26 0 0
117 27 0 0
35 27 0 0
37 27 0 0
118 28 0 0
36 28 0 0
38 28 0 0
137 39 0 0
138 39 0 0
40 39 0 0
52 39 0 0
109 40 0 0
51 40 0 0
137 40 0 0
138 40 0 0
110 40 0 0
70 40 0 0
63 40 0 0
64 40 0 0
52 40 0 0
69 40 0 0
43 41 0 0
72 41 0 0
196 41 0 0
53 41 0 0
110 41 0 0
105 41 0 0
59 41 0 0
67 41 0 0
55 41 0 0
69 41 0 0
44 42 0 0
73 42 0 0
195 42 0 0
54 42 0 0
105 42 0 0
109 42 0 0
60 42 0 0
68 42 0 0
56 42 0 0
70 42 0 0
72 43 0 0
196 43 0 0
78 43 0 0
110 43 0 0
182 43 0 0
67 43 0 0
73 44 0 0
195 44 0 0
79 44 0 0
109 44 0 0
181 44 0 0
68 44 0 0
191 45 0 0
65 45 0 0
74 45 0 0
57 45 0 0
143 45 0 0
151 45 0 0
66 46 0 0
75 46 0 0
58 46 0 0
192 46 0 0
144 46 0 0
152 46 0 0
57 47 0 0
59 47 0 0
61 47 0 0
67 47 0 0
58 48 0 0
60 48 0 0
62 48 0 0
68 48 0 0
63 49 0 0
55 49 0 0
65 49 0 0
69 49 0 0
56 50 0 0
66 50 0 0
70 50 0 0
64 50 0 0
101 53 0 0
105 53 0 0
101 54 0 0
105 54 0 0
119 55 0 0
120 56 0 0
119 59 0 0
120 60 0 0
101 61 0 0
113 61 0 0
101 62 0 0
113 62 0 0
114 63 0 0
114 64 0 0
101 67 0 0
101 68 0 0
110 69 0 0
109 70 0 0
81 71 0 0
82 71 0 0
114 71 0 0
83 72 0 0
85 72 0 0
84 73 0 0
86 73 0 0
87 74 0 0
89 74 0 0
88 75 0 0
90 75 0 0
91 76 0 0
93 76 0 0
119 76 0 0
120 77 0 0
92 77 0 0
94 77 0 0
95 78 0 0
110 78 0 0
97 78 0 0
109 79 0 0
96 79 0 0
98 79 0 0
99 80 0 0
100 80 0 0
105 101 0 0
133 101 0 0
155 102 0 0
167 102 0 0
139 102 0 0
156 102 0 0
168 102 0 0
140 102 0 0
132 102 0 0
104 102 0 0
134 103 0 0
106 103 0 0
165 103 0 0
153 103 0 0
154 103 0 0
135 103 0 0
136 103 0 0
166 103 0 0
111 104 0 0
139 104 0 0
112 104 0 0
140 104 0 0
158 104 0 0
170 104 0 0
129 104 0 0
157 104 0 0
169 104 0 0
132 104 0 0
133 105 0 0
130 105 0 0
172 106 0 0
159 106 0 0
160 106 0 0
131 106 0 0
134 106 0 0
171 106 0 0
107 106 0 0
135 106 0 0
136 106 0 0
108 106 0 0
112 107 0 0
172 107 0 0
115 107 0 0
198 107 0 0
141 107 0 0
169 107 0 0
149 107 0 0
165 107 0 0
179 107 0 0
135 107 0 0
111 108 0 0
171 108 0 0
116 108 0 0
197 108 0 0
136 108 0 0
142 108 0 0
170 108 0 0
150 108 0 0
166 108 0 0
180 108 0 0
181 109 0 0
137 109 0 0
138 110 0 0
182 110 0 0
139 111 0 0
143 111 0 0
151 111 0 0
171 111 0 0
116 111 0 0
167 111 0 0
183 111 0 0
170 111 0 0
194 111 0 0
140 112 0 0
144 112 0 0
152 112 0 0
172 112 0 0
115 112 0 0
168 112 0 0
184 112 0 0
169 112 0 0
193 112 0 0
175 113 0 0
176 113 0 0
155 113 0 0
156 113 0 0
174 114 0 0
159 114 0 0
160 114 0 0
168 115 0 0
184 115 0 0
198 115 0 0
165 115 0 0
179 115 0 0
193 115 0 0
167 116 0 0
183 116 0 0
197 116 0 0
166 116 0 0
180 116 0 0
194 116 0 0
161 117 0 0
145 117 0 0
185 117 0 0
186 118 0 0
162 118 0 0
146 118 0 0
187 119 0 0
147 119 0 0
163 119 0 0
188 120 0 0
148 120 0 0
164 120 0 0
145 121 0 0
149 121 0 0
165 121 0 0
153 121 0 0
154 122 0 0
146 122 0 0
150 122 0 0
166 122 0 0
147 123 0 0
155 123 0 0
167 123 0 0
151 123 0 0
148 124 0 0
156 124 0 0
168 124 0 0
152 124 0 0
141 125 0 0
157 125 0 0
161 125 0 0
169 125 0 0
142 126 0 0
158 126 0 0
162 126 0 0
170 126 0 0
159 127 0 0
143 127 0 0
171 127 0 0
163 127 0 0
144 128 0 0
172 128 0 0
164 128 0 0
160 128 0 0
202 173 0 0
204 173 0 0
205 174 0 0
203 174 0 0
206 175 0 0
210 175 0 0
211 176 0 0
207 176 0 0
208 177 0 0
212 177 0 0
209 178 0 0
213 178 0 0
214 179 0 0
220 179 0 0
215 180 0 0
221 180 0 0
216 181 0 0
222 181 0 0
217 182 0 0
223 182 0 0
224 183 0 0
218 183 0 0
225 184 0 0
219 184 0 0
226 185 0 0
230 185 0 0
227 186 0 0
231 186 0 0
232 187 0 0
228 187 0 0
233 188 0 0
229 188 0 0
234 189 0 0
238 189 0 0
235 190 0 0
239 190 0 0
240 191 0 0
236 191 0 0
241 192 0 0
237 192 0 0
242 193 0 0
248 193 0 0
243 194 0 0
249 194 0 0
244 195 0 0
250 195 0 0
245 196 0 0
251 196 0 0
246 197 0 0
252 197 0 0
253 198 0 0
247 198 0 0
254 199 0 0
257 199 0 0
255 200 0 0
258 200 0 0
256 201 0 0
259 201 0 0
@end
@Columns Bond
	AsymmetricBond	reference	AsymmetricBond
	Atom1	reference	Atom
	Atom2	reference	Atom
	CellOffset2	int	{{0 0 0}}
	Key	int	0
@end
@data
0 153 0 {0 0 0} 0
1 154 0 {0 0 0} 0
2 177 0 {0 0 0} 0
3 14 0 {0 0 0} 0
4 15 0 {0 0 0} 0
5 178 0 {0 0 0} 0
6 158 1 {0 1 0} 0
7 157 1 {0 0 0} 0
8 173 1 {0 0 0} 0
9 17 1 {0 1 0} 0
10 16 1 {0 0 0} 0
11 24 1 {0 0 0} 0
12 141 2 {0 0 0} 0
13 149 2 {0 0 0} 0
14 189 2 {0 0 0} 0
15 18 2 {0 0 0} 0
16 10 2 {0 0 0} 0
17 25 2 {0 0 0} 0
18 142 3 {0 0 0} 0
19 150 3 {0 0 0} 0
20 190 3 {0 0 0} 0
21 26 3 {0 0 0} 0
22 19 3 {0 0 0} 0
23 11 3 {0 0 0} 0
24 10 4 {0 0 0} 0
25 12 4 {0 0 0} 0
26 20 4 {0 0 0} 0
27 14 4 {0 0 0} 0
28 15 5 {0 0 0} 0
29 11 5 {0 0 0} 0
30 13 5 {0 0 0} 0
31 21 5 {0 0 0} 0
32 8 6 {0 0 0} 0
33 16 6 {0 0 0} 0
34 18 6 {0 0 0} 0
35 22 6 {0 0 0} 0
36 9 7 {0 0 0} 0
37 17 7 {0 0 0} 0
38 19 7 {0 0 0} 0
39 23 7 {0 0 0} 0
40 117 8 {0 0 0} 0
41 118 9 {0 0 0} 0
42 117 12 {-1 0 0} 0
43 118 13 {-1 0 0} 0
44 29 24 {0 0 0} 0
45 30 24 {0 0 0} 0
46 31 25 {0 0 0} 0
47 33 25 {0 0 0} 0
48 32 26 {0 0 0} 0
49 34 26 {0 0 0} 0
50 117 27 {-1 0 0} 0
51 35 27 {0 0 0} 0
52 37 27 {0 0 0} 0
53 118 28 {-1 0 0} 0
54 36 28 {0 0 0} 0
55 38 28 {0 0 0} 0
56 137 39 {0 0 0} 0
57 138 39 {0 0 0} 0
58 40 39 {0 0 0} 0
59 52 39 {0 0 0} 0
60 109 40 {0 0 0} 0
61 51 40 {0 0 0} 0
62 137 40 {0 0 0} 0
63 138 40 {0 0 0} 0
64 110 40 {0 0 0} 0
65 70 40 {0 0 0} 0
66 63 40 {0 0 0} 0
67 64 40 {0 0 0} 0
68 52 40 {0 0 0} 0
69 69 40 {0 0 0} 0
70 43 41 {0 0 0} 0
71 72 41 {0 0 0} 0
72 196 41 {0 0 0} 0
73 53 41 {0 0 0} 0
74 110 41 {0 0 0} 0
75 105 41 {0 -1 0} 0
76 59 41 {0 0 0} 0
77 67 41 {0 0 0} 0
78 55 41 {0 0 0} 0
79 69 41 {0 0 0} 0
80 44 42 {0 0 0} 0
81 73 42 {0 0 0} 0
82 195 42 {0 0 0} 0
83 54 42 {0 0 0} 0
84 105 42 {0 0 0} 0
85 109 42 {0 0 0} 0
86 60 42 {0 0 0} 0
87 68 42 {0 0 0} 0
88 56 42 {0 0 0} 0
89 70 42 {0 0 0} 0
90 72 43 {0 0 0} 0
91 196 43 {0 0 0} 0
92 78 43 {-1 0 0} 0
93 110 43 {-1 0 0} 0
94 182 43 {-1 0 0} 0
95 67 43 {0 0 0} 0
96 73 44 {0 0 0} 0
97 195 44 {0 0 0} 0
98 79 44 {-1 0 0} 0
99 109 44 {-1 0 0} 0
100 181 44 {-1 0 0} 0
101 68 44 {0 0 0} 0
102 191 45 {0 0 0} 0
103 65 45 {0 0 0} 0
104 74 45 {0 0 0} 0
105 57 45 {1 0 0} 0
106 143 45 {0 0 0} 0
107 151 45 {0 0 0} 0
108 66 46 {0 0 0} 0
109 75 46 {0 0 0} 0
110 58 46 {1 0 0} 0
111 192 46 {0 0 0} 0
112 144 46 {0 0 0} 0
113 152 46 {0 0 0} 0
114 57 47 {0 0 0} 0
115 59 47 {0 0 0} 0
116 61 47 {0 0 0} 0
117 67 47 {0 0 0} 0
118 58 48 {0 0 0} 0
119 60 48 {0 0 0} 0
120 62 48 {0 0 0} 0
121 68 48 {0 0 0} 0
122 63 49 {0 0 0} 0
123 55 49 {0 0 0} 0
124 65 49 {0 0 0} 0
125 69 49 {0 0 0} 0
126 56 50 {0 0 0} 0
127 66 50 {0 0 0} 0
128 70 50 {0 0 0} 0
129 64 50 {0 0 0} 0
130 101 53 {0 -1 0} 0
131 105 53 {0 -1 0} 0
132 101 54 {0 0 0} 0
133 105 54 {0 0 0} 0
134 119 55 {0 0 0} 0
135 120 56 {0 0 0} 0
136 119 59 {0 0 0} 0
137 120 60 {0 0 0} 0
138 101 61 {-1 -1 0} 0
139 113 61 {0 -1 0} 0
140 101 62 {-1 0 0} 0
141 113 62 {0 0 0} 0
142 114 63 {0 0 0} 0
143 114 64 {0 0 0} 0
144 101 67 {-1 -1 0} 0
145 101 68 {-1 0 0} 0
146 110 69 {0 0 0} 0
147 109 70 {0 0 0} 0
148 81 71 {0 0 0} 0
149 82 71 {0 0 0} 0
150 114 71 {0 0 0} 0
151 83 72 {0 0 0} 0
152 85 72 {0 0 0} 0
153 84 73 {0 0 0} 0
154 86 73 {0 0 0} 0
155 87 74 {0 0 0} 0
156 89 74 {0 0 0} 0
157 88 75 {0 0 0} 0
158 90 75 {0 0 0} 0
159 91 76 {0 0 0} 0
160 93 76 {0 0 0} 0
161 119 76 {0 0 0} 0
162 120 77 {0 0 0} 0
163 92 77 {0 0 0} 0
164 94 77 {0 0 0} 0
165 95 78 {0 0 0} 0
166 110 78 {0 0 0} 0
167 97 78 {0 0 0} 0
168 109 79 {0 0 0} 0
169 96 79 {0 0 0} 0
170 98 79 {0 0 0} 0
171 99 80 {0 0 0} 0
172 100 80 {0 0 0} 0
173 105 101 {0 0 0} 0
174 133 101 {0 0 0} 0
175 155 102 {0 1 0} 0
176 167 102 {0 1 0} 0
177 139 102 {0 1 0} 0
178 156 102 {0 0 0} 0
179 168 102 {0 0 0} 0
180 140 102 {0 0 0} 0
181 132 102 {0 0 0} 0
182 104 102 {0 0 0} 0
183 134 103 {0 0 0} 0
184 106 103 {-1 0 0} 0
185 165 103 {0 0 0} 0
186 153 103 {0 0 0} 0
187 154 103 {0 0 0} 0
188 135 103 {-1 0 0} 0
189 136 103 {-1 0 0} 0
190 166 103 {0 0 0} 0
191 111 104 {0 1 0} 0
192 139 104 {0 1 0} 0
193 112 104 {0 0 0} 0
194 140 104 {0 0 0} 0
195 158 104 {0 1 0} 0
196 170 104 {0 1 0} 0
197 129 104 {0 0 0} 0
198 157 104 {0 0 0} 0
199 169 104 {0 0 0} 0
200 132 104 {0 0 0} 0
201 133 105 {0 0 0} 0
202 130 105 {0 0 0} 0
203 172 106 {0 0 0} 0
204 159 106 {0 0 0} 0
205 160 106 {0 0 0} 0
206 131 106 {0 0 0} 0
207 134 106 {1 0 0} 0
208 171 106 {0 0 0} 0
209 107 106 {0 0 0} 0
210 135 106 {0 0 0} 0
211 136 106 {0 0 0} 0
212 108 106 {0 0 0} 0
213 112 107 {0 0 0} 0
214 172 107 {0 0 0} 0
215 115 107 {0 0 0} 0
216 198 107 {0 0 0} 0
217 141 107 {0 0 0} 0
218 169 107 {0 0 0} 0
219 149 107 {0 0 0} 0
220 165 107 {0 0 0} 0
221 179 107 {0 0 0} 0
222 135 107 {0 0 0} 0
223 111 108 {0 0 0} 0
224 171 108 {0 0 0} 0
225 116 108 {0 0 0} 0
226 197 108 {0 0 0} 0
227 136 108 {0 0 0} 0
228 142 108 {0 0 0} 0
229 170 108 {0 0 0} 0
230 150 108 {0 0 0} 0
231 166 108 {0 0 0} 0
232 180 108 {0 0 0} 0
233 181 109 {0 0 0} 0
234 137 109 {0 0 0} 0
235 138 110 {0 0 0} 0
236 182 110 {0 0 0} 0
237 139 111 {0 0 0} 0
238 143 111 {0 0 0} 0
239 151 111 {0 0 0} 0
240 171 111 {0 0 0} 0
241 116 111 {1 0 0} 0
242 167 111 {1 0 0} 0
243 183 111 {1 0 0} 0
244 170 111 {0 0 0} 0
245 194 111 {1 0 0} 0
246 140 112 {0 0 0} 0
247 144 112 {0 0 0} 0
248 152 112 {0 0 0} 0
249 172 112 {0 0 0} 0
250 115 112 {1 0 0} 0
251 168 112 {1 0 0} 0
252 184 112 {1 0 0} 0
253 169 112 {0 0 0} 0
254 193 112 {1 0 0} 0
255 175 113 {0 0 0} 0
256 176 113 {-1 0 0} 0
257 155 113 {0 1 0} 0
258 156 113 {0 0 0} 0
259 174 114 {0 0 0} 0
260 159 114 {0 0 0} 0
261 160 114 {0 0 0} 0
262 168 115 {0 0 0} 0
263 184 115 {0 0 0} 0
264 198 115 {0 0 0} 0
265 165 115 {0 0 0} 0
266 179 115 {0 0 0} 0
267 193 115 {0 0 0} 0
268 167 116 {0 0 0} 0
269 183 116 {0 0 0} 0
270 197 116 {0 0 0} 0
271 166 116 {0 0 0} 0
272 180 116 {0 0 0} 0
273 194 116 {0 0 0} 0
274 161 117 {0 0 0} 0
275 145 117 {1 0 0} 0
276 185 117 {0 0 0} 0
277 186 118 {0 0 0} 0
278 162 118 {0 0 0} 0
279 146 118 {1 0 0} 0
280 187 119 {0 0 0} 0
281 147 119 {0 0 0} 0
282 163 119 {0 0 0} 0
283 188 120 {0 0 0} 0
284 148 120 {0 0 0} 0
285 164 120 {0 0 0} 0
286 145 121 {0 0 0} 0
287 149 121 {0 0 0} 0
288 165 121 {0 0 0} 0
289 153 121 {0 0 0} 0
290 154 122 {0 0 0} 0
291 146 122 {0 0 0} 0
292 150 122 {0 0 0} 0
293 166 122 {0 0 0} 0
294 147 123 {0 0 0} 0
295 155 123 {0 0 0} 0
296 167 123 {0 0 0} 0
297 151 123 {-1 0 0} 0
298 148 124 {0 0 0} 0
299 156 124 {0 0 0} 0
300 168 124 {0 0 0} 0
301 152 124 {-1 0 0} 0
302 141 125 {0 0 0} 0
303 157 125 {0 0 0} 0
304 161 125 {0 0 0} 0
305 169 125 {0 0 0} 0
306 142 126 {0 0 0} 0
307 158 126 {0 0 0} 0
308 162 126 {0 0 0} 0
309 170 126 {0 0 0} 0
310 159 127 {0 0 0} 0
311 143 127 {0 0 0} 0
312 171 127 {0 0 0} 0
313 163 127 {0 0 0} 0
314 144 128 {0 0 0} 0
315 172 128 {0 0 0} 0
316 164 128 {0 0 0} 0
317 160 128 {0 0 0} 0
318 202 173 {0 0 0} 0
319 204 173 {1 0 0} 0
320 205 174 {0 0 0} 0
321 203 174 {0 0 0} 0
322 206 175 {0 0 0} 0
323 210 175 {0 0 0} 0
324 211 176 {0 0 0} 0
325 207 176 {0 0 0} 0
326 208 177 {0 0 0} 0
327 212 177 {0 0 0} 0
328 209 178 {0 0 0} 0
329 213 178 {-1 0 0} 0
330 214 179 {0 0 0} 0
331 220 179 {0 0 0} 0
332 215 180 {0 0 0} 0
333 221 180 {0 0 0} 0
334 216 181 {0 0 0} 0
335 222 181 {0 0 0} 0
336 217 182 {0 0 0} 0
337 223 182 {0 0 0} 0
338 224 183 {0 0 0} 0
339 218 183 {-1 0 0} 0
340 225 184 {0 0 0} 0
341 219 184 {-1 0 0} 0
342 226 185 {0 0 0} 0
343 230 185 {1 0 0} 0
344 227 186 {0 0 0} 0
345 231 186 {1 0 0} 0
346 232 187 {0 0 0} 0
347 228 187 {0 0 0} 0
348 233 188 {0 0 0} 0
349 229 188 {0 0 0} 0
350 234 189 {0 0 0} 0
351 238 189 {0 0 0} 0
352 235 190 {0 0 0} 0
353 239 190 {0 0 0} 0
354 240 191 {0 0 0} 0
355 236 191 {1 0 0} 0
356 241 192 {0 0 0} 0
357 237 192 {1 0 0} 0
358 242 193 {0 0 0} 0
359 248 193 {-1 0 0} 0
360 243 194 {0 0 0} 0
361 249 194 {-1 0 0} 0
362 244 195 {0 0 0} 0
363 250 195 {0 0 0} 0
364 245 196 {0 0 0} 0
365 251 196 {0 0 0} 0
366 246 197 {0 0 0} 0
367 252 197 {0 0 0} 0
368 253 198 {0 0 0} 0
369 247 198 {0 0 0} 0
370 254 199 {0 0 0} 0
371 257 199 {0 0 0} 0
372 255 200 {0 0 0} 0
373 258 200 {0 0 0} 0
374 256 201 {0 0 0} 0
375 259 201 {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