Number of particles = 238 A = 1 Angstrom (basic length-scale) H0(1,1) = 6.362 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 62.3068 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 6.96175 A .NO_VELOCITY. entry_count = 7 auxiliary[0] = id auxiliary[1] = v_mass_metal auxiliary[2] = v_csym_metal auxiliary[3] = v_particle_eng_metal 55.845000 Fe 0.150131 0.0182996 0.395079 123 55.845 6.21581 -4.03857 55.845000 Fe 0.557198 0.0318637 0.57979 125 55.845 0.339631 -3.97879 55.845000 Fe 0.877846 0.0470286 0.406226 129 55.845 0.23217 -3.95207 55.845000 Fe 0.981875 0.0409818 0.739892 130 55.845 5.36773 -3.91697 55.845000 Fe 0.844926 0.00904842 0.619225 131 55.845 10.3125 -4.04591 55.845000 Fe 0.272083 0.0570474 0.575251 137 55.845 5.43796 -3.98973 55.845000 Fe 0.377846 0.0470286 0.906226 138 55.845 0.23217 -3.95207 55.845000 Fe 0.263958 0.0149506 0.722939 139 55.845 8.51611 -3.92496 55.845000 Fe 0.344926 0.00904842 0.119225 140 55.845 10.3125 -4.04591 55.845000 Fe 0.772083 0.0570474 0.0752505 148 55.845 5.43796 -3.98973 55.845000 Fe 0.650131 0.0182996 0.895079 149 55.845 6.21581 -4.03857 55.845000 Fe 0.763958 0.0149506 0.222939 150 55.845 8.51611 -3.92496 55.845000 Fe 0.0571981 0.0318637 0.0797898 161 55.845 0.339631 -3.97879 55.845000 Fe 0.481875 0.0409818 0.239892 173 55.845 5.36773 -3.91697 55.845000 Fe 0.670399 0.0641023 0.746445 147 55.845 0.069787 -3.99103 55.845000 Fe 0.170399 0.0641023 0.246445 160 55.845 0.069787 -3.99103 55.845000 Fe 0.572021 0.0728997 0.412821 124 55.845 0.0306703 -3.98071 55.845000 Fe 0.972288 0.122766 0.418123 127 55.845 0.00224618 -4.01916 55.845000 Fe 0.967792 0.0805371 0.578604 128 55.845 0.0509003 -3.98081 55.845000 Fe 0.271597 0.0976749 0.41569 135 55.845 0.00541485 -4.00515 55.845000 Fe 0.372688 0.0899902 0.750579 136 55.845 0.0338223 -4.00896 55.845000 Fe 0.672413 0.106157 0.583113 145 55.845 0.00563996 -4.02678 55.845000 Fe 0.771597 0.0976749 0.91569 146 55.845 0.00541485 -4.00515 55.845000 Fe 0.0706575 0.114387 0.750635 157 55.845 0.0042437 -4.03374 55.845000 Fe 0.172413 0.106157 0.0831126 158 55.845 0.00563996 -4.02678 55.845000 Fe 0.0720213 0.0728997 0.912821 159 55.845 0.0306703 -3.98071 55.845000 Fe 0.472288 0.122766 0.918123 170 55.845 0.00224618 -4.01916 55.845000 Fe 0.570657 0.114387 0.250635 171 55.845 0.0042437 -4.03374 55.845000 Fe 0.467792 0.0805371 0.0786042 172 55.845 0.0509003 -3.98081 55.845000 Fe 0.872688 0.0899902 0.250579 185 55.845 0.0338223 -4.00896 55.845000 Fe 0.370911 0.131091 0.584366 134 55.845 0.000799476 -4.01815 55.845000 Fe 0.870911 0.131091 0.0843658 184 55.845 0.000799476 -4.01815 55.845000 Fe 0.371721 0.172863 0.420305 133 55.845 5.60144e-05 -4.02066 55.845000 Fe 0.771638 0.181193 0.587509 142 55.845 5.59078e-05 -4.02072 55.845000 Fe 0.671454 0.147867 0.419347 143 55.845 0.000535078 -4.02278 55.845000 Fe 0.771754 0.13948 0.751668 144 55.845 0.000329764 -4.02212 55.845000 Fe 0.171785 0.189556 0.754548 154 55.845 6.93371e-05 -4.02127 55.845000 Fe 0.0720138 0.156155 0.586157 155 55.845 0.000190688 -4.02306 55.845000 Fe 0.171454 0.147867 0.919347 156 55.845 0.000535078 -4.02278 55.845000 Fe 0.471409 0.164447 0.75332 168 55.845 0.000359556 -4.0244 55.845000 Fe 0.572014 0.156155 0.0861566 169 55.845 0.000190688 -4.02306 55.845000 Fe 0.871721 0.172863 0.920305 182 55.845 5.60144e-05 -4.02066 55.845000 Fe 0.971409 0.164447 0.25332 183 55.845 0.000359556 -4.0244 55.845000 Fe 0.271638 0.181193 0.0875089 196 55.845 5.59078e-05 -4.02072 55.845000 Fe 0.271754 0.13948 0.251668 197 55.845 0.000329764 -4.02212 55.845000 Fe 0.671785 0.189556 0.254548 209 55.845 6.93371e-05 -4.02127 55.845000 Fe 0.0718527 0.197876 0.421573 153 55.845 3.06512e-05 -4.02282 55.845000 Fe 0.571853 0.197876 0.921573 167 55.845 3.06512e-05 -4.02282 55.845000 Fe 0.772101 0.222932 0.422514 141 55.845 1.05776e-05 -4.02159 55.845000 Fe 0.172129 0.231293 0.589441 152 55.845 2.05805e-05 -4.02184 55.845000 Fe 0.472389 0.247979 0.423215 164 55.845 2.73759e-06 -4.02222 55.845000 Fe 0.572239 0.239632 0.756357 165 55.845 4.53678e-06 -4.02211 55.845000 Fe 0.471946 0.206238 0.588697 166 55.845 4.98949e-05 -4.02214 55.845000 Fe 0.872469 0.256321 0.590149 178 55.845 1.12389e-05 -4.02171 55.845000 Fe 0.972389 0.247979 0.923215 179 55.845 2.73759e-06 -4.02222 55.845000 Fe 0.871909 0.214573 0.755611 180 55.845 4.01572e-05 -4.02176 55.845000 Fe 0.971946 0.206238 0.0886974 181 55.845 4.98949e-05 -4.02214 55.845000 Fe 0.372469 0.256321 0.0901493 193 55.845 1.12389e-05 -4.02171 55.845000 Fe 0.272101 0.222932 0.922514 194 55.845 1.05776e-05 -4.02159 55.845000 Fe 0.371909 0.214573 0.255611 195 55.845 4.01572e-05 -4.02176 55.845000 Fe 0.672129 0.231293 0.0894406 208 55.845 2.05805e-05 -4.02184 55.845000 Fe 0.0722387 0.239632 0.256357 220 55.845 4.53678e-06 -4.02211 55.845000 Fe 0.272581 0.264672 0.757077 192 55.845 2.06348e-05 -4.02126 55.845000 Fe 0.772581 0.264672 0.257077 207 55.845 2.06348e-05 -4.02126 55.845000 Fe 0.172686 0.273029 0.423909 151 55.845 2.27735e-05 -4.02119 55.845000 Fe 0.573521 0.323092 0.424527 162 55.845 3.3074e-05 -4.02062 55.845000 Fe 0.572812 0.281376 0.59068 163 55.845 1.78193e-05 -4.02168 55.845000 Fe 0.873142 0.29807 0.424287 176 55.845 1.57104e-05 -4.02228 55.845000 Fe 0.972913 0.289711 0.757467 177 55.845 8.90369e-06 -4.02164 55.845000 Fe 0.273177 0.306398 0.591043 190 55.845 3.48883e-05 -4.01983 55.845000 Fe 0.373142 0.29807 0.924287 191 55.845 1.57104e-05 -4.02228 55.845000 Fe 0.673362 0.314744 0.757779 204 55.845 4.05311e-05 -4.02091 55.845000 Fe 0.773177 0.306398 0.0910426 205 55.845 3.48883e-05 -4.01983 55.845000 Fe 0.672686 0.273029 0.923909 206 55.845 2.27735e-05 -4.02119 55.845000 Fe 0.0735209 0.323092 0.924527 217 55.845 3.3074e-05 -4.02062 55.845000 Fe 0.173362 0.314744 0.257779 218 55.845 4.05311e-05 -4.02091 55.845000 Fe 0.072812 0.281376 0.0906795 219 55.845 1.78193e-05 -4.02168 55.845000 Fe 0.472913 0.289711 0.257467 230 55.845 8.90369e-06 -4.02164 55.845000 Fe 0.973862 0.331495 0.591343 175 55.845 0.000287654 -4.02505 55.845000 Fe 0.473862 0.331495 0.0913434 229 55.845 0.000287654 -4.02505 55.845000 Fe 0.273623 0.389798 0.259034 18 55.845 0.00620544 -4.02484 55.845000 Fe 0.973497 0.373196 0.424495 174 55.845 0.00244323 -4.02039 55.845000 Fe 0.375351 0.381572 0.591784 187 55.845 0.0045669 -4.03446 55.845000 Fe 0.27402 0.348081 0.424631 188 55.845 0.000515777 -4.02247 55.845000 Fe 0.373415 0.33979 0.758026 189 55.845 0.000181272 -4.0219 55.845000 Fe 0.773623 0.389798 0.759034 201 55.845 0.00620544 -4.02484 55.845000 Fe 0.673854 0.356469 0.591826 202 55.845 0.000348762 -4.0218 55.845000 Fe 0.77402 0.348081 0.924631 203 55.845 0.000515777 -4.02247 55.845000 Fe 0.0748998 0.364867 0.75887 215 55.845 0.00101508 -4.01828 55.845000 Fe 0.173854 0.356469 0.0918264 216 55.845 0.000348762 -4.0218 55.845000 Fe 0.473497 0.373196 0.924495 227 55.845 0.00244323 -4.02039 55.845000 Fe 0.5749 0.364867 0.25887 228 55.845 0.00101508 -4.01828 55.845000 Fe 0.875351 0.381572 0.0917845 236 55.845 0.0045669 -4.03446 55.845000 Fe 0.873415 0.33979 0.258026 237 55.845 0.000181272 -4.0219 55.845000 Fe 0.674281 0.398291 0.426073 200 55.845 0.00592249 -4.0075 55.845000 Fe 0.174281 0.398291 0.926073 214 55.845 0.00592249 -4.0075 55.845000 Fe 0.675214 0.438906 0.264277 15 55.845 5.40224 -3.98672 55.845000 Fe 0.276358 0.431832 0.0937814 99 55.845 0.0706247 -3.98801 55.845000 Fe 0.373757 0.423147 0.427271 186 55.845 0.034131 -3.98599 55.845000 Fe 0.776358 0.431832 0.593781 199 55.845 0.0706247 -3.98801 55.845000 Fe 0.0681463 0.449124 0.433385 211 55.845 0.269686 -3.95425 55.845000 Fe 0.175214 0.438906 0.764277 212 55.845 5.40224 -3.98672 55.845000 Fe 0.073772 0.405998 0.59083 213 55.845 0.0322503 -4.00884 55.845000 Fe 0.464472 0.45499 0.597703 223 55.845 5.47627 -3.92547 55.845000 Fe 0.568146 0.449124 0.933385 224 55.845 0.269686 -3.95425 55.845000 Fe 0.479261 0.415476 0.762573 225 55.845 0.0594456 -3.98401 55.845000 Fe 0.573772 0.405998 0.0908299 226 55.845 0.0322503 -4.00884 55.845000 Fe 0.964472 0.45499 0.0977026 233 55.845 5.47627 -3.92547 55.845000 Fe 0.873757 0.423147 0.927271 234 55.845 0.034131 -3.98599 55.845000 Fe 0.979261 0.415476 0.262573 235 55.845 0.0594456 -3.98401 55.845000 Fe 0.392692 0.464176 0.256722 101 55.845 0.376219 -3.97272 55.845000 Fe 0.892692 0.464176 0.756722 232 55.845 0.376219 -3.97272 55.845000 Fe 0.104273 0.486754 0.21547 14 55.845 10.1885 -4.04792 55.845000 Fe 0.683844 0.481402 0.11294 16 55.845 8.41293 -3.92763 55.845000 Fe 0.808327 0.524154 0.58376 76 55.845 5.44155 -4.21284 55.845000 Fe 0.240494 0.516519 0.755778 77 55.845 8.8127 -4.05202 55.845000 Fe 0.62005 0.513186 0.938572 100 55.845 5.00051 -4.04652 55.845000 Fe 0.308327 0.524154 0.0837602 106 55.845 5.44155 -4.21284 55.845000 Fe 0.740494 0.516519 0.255778 120 55.845 8.8127 -4.05202 55.845000 Fe 0.12005 0.513186 0.438572 121 55.845 5.00051 -4.04652 55.845000 Fe 0.799609 0.477537 0.440953 198 55.845 6.14162 -4.03956 55.845000 Fe 0.183844 0.481402 0.61294 210 55.845 8.41293 -3.92763 55.845000 Fe 0.474313 0.498081 0.415924 221 55.845 6.69935 -3.94722 55.845000 Fe 0.604273 0.486754 0.71547 222 55.845 10.1885 -4.04792 55.845000 Fe 0.974313 0.498081 0.915924 231 55.845 6.69935 -3.94722 55.845000 Fe 0.299609 0.477537 0.940953 238 55.845 6.14162 -4.03956 55.845000 Fe 0.926038 0.535494 0.906012 104 55.845 1.61699 -3.92938 55.845000 Fe 0.426038 0.535494 0.406012 107 55.845 1.61699 -3.92938 55.845000 Fe 0.428686 0.576545 0.57509 40 55.845 0.0333735 -3.94652 55.845000 Fe 0.826466 0.568197 0.736845 78 55.845 0.0315216 -3.96761 55.845000 Fe 0.128237 0.553344 0.575062 79 55.845 5.50618 -3.92052 55.845000 Fe 0.223712 0.560275 0.905024 80 55.845 0.0612965 -3.95866 55.845000 Fe 0.123757 0.593737 0.740352 83 55.845 0.0097437 -3.96642 55.845000 Fe 0.523497 0.542763 0.739517 102 55.845 0.217752 -4.00279 55.845000 Fe 0.628237 0.553344 0.0750622 103 55.845 5.50618 -3.92052 55.845000 Fe 0.0234974 0.542763 0.239517 105 55.845 0.217752 -4.00279 55.845000 Fe 0.524961 0.585203 0.905626 108 55.845 0.0110903 -3.99806 55.845000 Fe 0.623757 0.593737 0.240352 109 55.845 0.0097437 -3.96642 55.845000 Fe 0.928686 0.576545 0.0750895 110 55.845 0.0333735 -3.94652 55.845000 Fe 0.0249611 0.585203 0.405626 111 55.845 0.0110903 -3.99806 55.845000 Fe 0.326466 0.568197 0.236845 112 55.845 0.0315216 -3.96761 55.845000 Fe 0.723712 0.560275 0.405024 122 55.845 0.0612965 -3.95866 55.845000 Fe 0.724853 0.601786 0.574137 81 55.845 0.0035651 -4.01246 55.845000 Fe 0.224853 0.601786 0.0741369 84 55.845 0.0035651 -4.01246 55.845000 Fe 0.0260269 0.626833 0.57354 41 55.845 0.00111317 -4.02346 55.845000 Fe 0.425199 0.61849 0.739818 42 55.845 0.00126483 -4.03021 55.845000 Fe 0.326075 0.651966 0.574453 45 55.845 0.00019706 -4.02106 55.845000 Fe 0.426224 0.660261 0.908016 46 55.845 7.95341e-05 -4.02428 55.845000 Fe 0.825929 0.610277 0.906573 82 55.845 0.00201325 -4.03749 55.845000 Fe 0.725965 0.643612 0.740756 85 55.845 0.000174573 -4.0212 55.845000 Fe 0.826075 0.651966 0.0744529 86 55.845 0.00019706 -4.02106 55.845000 Fe 0.126249 0.635244 0.907721 87 55.845 0.000351476 -4.01889 55.845000 Fe 0.225965 0.643612 0.240756 88 55.845 0.000174573 -4.0212 55.845000 Fe 0.526027 0.626833 0.0735398 113 55.845 0.00111317 -4.02346 55.845000 Fe 0.626249 0.635244 0.407721 114 55.845 0.000351476 -4.01889 55.845000 Fe 0.925199 0.61849 0.239818 115 55.845 0.00126483 -4.03021 55.845000 Fe 0.325929 0.610277 0.406573 116 55.845 0.00201325 -4.03749 55.845000 Fe 0.926224 0.660261 0.408016 118 55.845 7.95341e-05 -4.02428 55.845000 Fe 0.0264335 0.668616 0.741323 44 55.845 6.27253e-05 -4.02294 55.845000 Fe 0.526434 0.668616 0.241323 117 55.845 6.27253e-05 -4.02294 55.845000 Fe 0.227262 0.727065 0.576168 19 55.845 1.55823e-05 -4.02108 55.845000 Fe 0.626457 0.676976 0.57494 43 55.845 1.08636e-05 -4.02069 55.845000 Fe 0.627148 0.718716 0.742594 47 55.845 9.93334e-06 -4.02157 55.845000 Fe 0.926883 0.702017 0.575462 48 55.845 7.38926e-06 -4.02197 55.845000 Fe 0.0270686 0.710365 0.909029 49 55.845 1.16795e-05 -4.02168 55.845000 Fe 0.326743 0.693688 0.741928 50 55.845 3.1749e-05 -4.02147 55.845000 Fe 0.426883 0.702017 0.0754624 51 55.845 7.38926e-06 -4.02197 55.845000 Fe 0.726704 0.685326 0.908416 89 55.845 1.68826e-05 -4.02113 55.845000 Fe 0.826743 0.693688 0.241928 90 55.845 3.1749e-05 -4.02147 55.845000 Fe 0.126457 0.676976 0.0749399 91 55.845 1.08636e-05 -4.02069 55.845000 Fe 0.226704 0.685326 0.408416 92 55.845 1.68826e-05 -4.02113 55.845000 Fe 0.727262 0.727065 0.0761677 93 55.845 1.55823e-05 -4.02108 55.845000 Fe 0.127148 0.718716 0.242594 95 55.845 9.93334e-06 -4.02157 55.845000 Fe 0.527069 0.710365 0.409029 119 55.845 1.16795e-05 -4.02168 55.845000 Fe 0.327426 0.735415 0.909835 56 55.845 9.2215e-06 -4.02097 55.845000 Fe 0.827426 0.735415 0.409835 94 55.845 9.2215e-06 -4.02097 55.845000 Fe 0.82796 0.777158 0.578254 20 55.845 1.82073e-06 -4.02156 55.845000 Fe 0.227858 0.768809 0.744551 21 55.845 1.79868e-06 -4.02164 55.845000 Fe 0.527626 0.75211 0.577136 52 55.845 6.13508e-06 -4.02179 55.845000 Fe 0.627748 0.760457 0.910844 53 55.845 3.24677e-06 -4.02131 55.845000 Fe 0.927556 0.743762 0.743451 54 55.845 1.2047e-05 -4.02166 55.845000 Fe 0.0276258 0.75211 0.0771358 55 55.845 6.13508e-06 -4.02179 55.845000 Fe 0.427556 0.743762 0.243451 57 55.845 1.2047e-05 -4.02166 55.845000 Fe 0.528246 0.793856 0.745696 58 55.845 1.23208e-05 -4.02205 55.845000 Fe 0.928059 0.785514 0.911947 60 55.845 8.50808e-06 -4.02205 55.845000 Fe 0.0282456 0.793856 0.245696 61 55.845 1.23208e-05 -4.02205 55.845000 Fe 0.32796 0.777158 0.0782544 62 55.845 1.82073e-06 -4.02156 55.845000 Fe 0.428059 0.785514 0.411947 63 55.845 8.50808e-06 -4.02205 55.845000 Fe 0.727858 0.768809 0.244551 96 55.845 1.79868e-06 -4.02164 55.845000 Fe 0.127748 0.760457 0.410844 97 55.845 3.24677e-06 -4.02131 55.845000 Fe 0.128292 0.802209 0.579409 23 55.845 1.58163e-05 -4.02146 55.845000 Fe 0.628292 0.802209 0.0794092 59 55.845 1.58163e-05 -4.02146 55.845000 Fe 0.428582 0.827269 0.580905 2 55.845 6.32425e-05 -4.02242 55.845000 Fe 0.828518 0.818908 0.747045 22 55.845 1.36101e-05 -4.02056 55.845000 Fe 0.228477 0.810555 0.913182 24 55.845 2.06205e-05 -4.02089 55.845000 Fe 0.728875 0.852275 0.582191 25 55.845 0.000299926 -4.02288 55.845000 Fe 0.828463 0.860637 0.915578 26 55.845 0.000329382 -4.01939 55.845000 Fe 0.128904 0.843931 0.748338 27 55.845 0.00022357 -4.02037 55.845000 Fe 0.228875 0.852275 0.0821912 28 55.845 0.000299926 -4.02288 55.845000 Fe 0.528661 0.835641 0.91452 64 55.845 0.00013592 -4.02395 55.845000 Fe 0.628904 0.843931 0.248338 65 55.845 0.00022357 -4.02037 55.845000 Fe 0.928582 0.827269 0.0809051 66 55.845 6.32425e-05 -4.02242 55.845000 Fe 0.0286609 0.835641 0.41452 67 55.845 0.00013592 -4.02395 55.845000 Fe 0.328518 0.818908 0.247045 68 55.845 1.36101e-05 -4.02056 55.845000 Fe 0.328463 0.860637 0.415578 72 55.845 0.000329382 -4.01939 55.845000 Fe 0.728477 0.810555 0.413182 98 55.845 2.06205e-05 -4.02089 55.845000 Fe 0.428294 0.869086 0.749818 4 55.845 0.00110306 -4.02401 55.845000 Fe 0.928294 0.869086 0.249818 71 55.845 0.00110306 -4.02401 55.845000 Fe 0.0293785 0.877428 0.583986 3 55.845 0.00144673 -4.02876 55.845000 Fe 0.62689 0.927617 0.589031 5 55.845 0.0288236 -3.96186 55.845000 Fe 0.0243719 0.919341 0.750796 6 55.845 0.0334561 -3.94665 55.845000 Fe 0.329852 0.902247 0.583996 7 55.845 0.00813826 -3.96807 55.845000 Fe 0.428751 0.910675 0.919874 8 55.845 0.0128292 -4.00056 55.845000 Fe 0.729029 0.894092 0.750662 29 55.845 0.00297597 -4.01492 55.845000 Fe 0.829852 0.902247 0.0839959 30 55.845 0.00813826 -3.96807 55.845000 Fe 0.128286 0.885629 0.917485 31 55.845 0.00176753 -4.03506 55.845000 Fe 0.229029 0.894092 0.250662 32 55.845 0.00297597 -4.01492 55.845000 Fe 0.12689 0.927617 0.0890313 35 55.845 0.0288236 -3.96186 55.845000 Fe 0.529379 0.877428 0.0839862 69 55.845 0.00144673 -4.02876 55.845000 Fe 0.628286 0.885629 0.417485 70 55.845 0.00176753 -4.03506 55.845000 Fe 0.524372 0.919341 0.250796 73 55.845 0.0334561 -3.94665 55.845000 Fe 0.928751 0.910675 0.419874 74 55.845 0.0128292 -4.00056 55.845000 Fe 0.474864 0.99784 0.419374 126 55.845 6.57804 -3.96024 55.845000 Fe 0.974864 0.99784 0.919374 132 55.845 6.57804 -3.96024 55.845000 Fe 0.729113 0.935933 0.92073 33 55.845 0.0476045 -3.95622 55.845000 Fe 0.229113 0.935933 0.42073 36 55.845 0.0476045 -3.95622 55.845000 Fe 0.207573 0.979516 0.575951 1 55.845 8.62281 -4.04743 55.845000 Fe 0.642828 0.971481 0.745953 9 55.845 5.38454 -4.21175 55.845000 Fe 0.928716 0.953143 0.588478 10 55.845 0.212781 -3.98902 55.845000 Fe 0.0287829 0.960462 0.921454 11 55.845 1.65363 -3.93564 55.845000 Fe 0.324945 0.942446 0.750738 12 55.845 5.73119 -3.92271 55.845000 Fe 0.428716 0.953143 0.0884785 13 55.845 0.212781 -3.98902 55.845000 Fe 0.332327 0.983024 0.891741 17 55.845 4.93459 -4.05274 55.845000 Fe 0.824945 0.942446 0.250738 34 55.845 5.73119 -3.92271 55.845000 Fe 0.707573 0.979516 0.0759514 37 55.845 8.62281 -4.04743 55.845000 Fe 0.832327 0.983024 0.391741 38 55.845 4.93459 -4.05274 55.845000 Fe 0.142828 0.971481 0.245953 39 55.845 5.38454 -4.21175 55.845000 Fe 0.528783 0.960462 0.421454 75 55.845 1.65363 -3.93564