H GEN 0 1 3 1.00000000000000 1 21.24359508259891 21.24359508259891 3 21.24359508259891 -10.85192405303825 2 21.77696655044365 1 0.00000000000000 2 1.000000000000000 He GEN 0 1 3 2.000000 1 32.000000 64.00000 3 32.000000 -27.70084 2 33.713355 1 0.000000 2 1.0000000 Li GEN 2 1 3 1.000 1 15.0000000000000 15.0000000000000 3 15.0479971422127 -1.24272969818004 2 1.80605426846072 1 6.75286789026804 2 1.33024777689591 Be GEN 2 1 4 2 1 17.94900205362972 35.89800410725944 3 24.13200289331664 -12.77499846818315 2 20.13800265282147 -2.96001382478467 2 4.333170937885760 1 12.66391859014478 2 2.487403700772570 B GEN 2 1 3 3.00000 1 31.49298 94.47895 3 22.56509 -9.74800 2 8.64669 1 20.74800 2 4.06246 C GEN 2 1 3 4.00000 1 14.43502 57.74008 3 8.39889 -25.81955 2 7.38188 1 52.13345 2 7.76079 N GEN 2 1 6 3.25000 1 12.91881 1.75000 1 9.22825 41.98612 3 12.96581 16.14945 3 8.05477 -26.09522 2 12.54876 -10.32626 2 7.53360 2 34.77692 2 9.41609 15.20330 2 8.16694 O GEN 2 1 3 6.000000 1 12.30997 73.85984 3 14.76962 -47.87600 2 13.71419 1 85.86406 2 13.65512 F GEN 2 1 3 7.0 1 12.08758490486192 84.61309433403344 3 12.83806306400466 -53.02751706539332 2 12.31234562699041 1 78.90177172847011 2 14.78076492090162 Ne GEN 2 1 3 8.000 1 14.79351199705315 118.34809597642520 3 16.58203947626090 -70.27885884380557 2 16.08073529218220 1 81.62205749824426 2 16.55441468334002 Na GEN 10 2 3 1.000000 1 4.311678 4.311678 3 1.925689 -2.083137 2 1.549498 2 6.234064 2 5.377666 9.075931 2 1.408414 2 3.232724 2 1.379949 2.494079 2 0.862453 Mg GEN 10 2 3 2.000000 1 6.048538 12.097075 3 2.796989 -17.108313 2 2.547408 2 6.428631 2 5.936017 14.195491 2 1.592891 2 3.315069 2 1.583969 4.403025 2 1.077297 Al GEN 10 2 3 3.000000 1 5.073893 15.221680 3 8.607001 -11.165685 2 3.027490 2 14.879513 2 7.863954 20.746863 2 2.061358 2 7.786227 2 3.125175 7.109015 2 1.414930 Si GEN 10 2 3 4.000000 1 5.168316 20.673264 3 8.861690 -14.818174 2 3.933474 2 14.832760 2 9.447023 26.349664 2 2.553812 2 7.621400 2 3.660001 10.331583 2 1.903653 P GEN 10 2 3 5.000000 1 5.872694 29.363469 3 9.891298 -17.011136 2 4.692469 2 15.259383 2 12.091334 31.707918 2 3.044535 2 7.747190 2 4.310884 13.932528 2 2.426903 S GEN 10 2 3 6.000000 1 6.151144 36.906864 3 11.561575 -19.819533 2 5.390961 2 15.925748 2 16.117687 38.515895 2 3.608629 2 8.062221 2 6.228956 18.737525 2 2.978074 Cl GEN 10 2 3 7.000000 1 7.944352 55.610463 3 12.801261 -22.860784 2 6.296744 2 15.839234 2 17.908432 44.469504 2 4.159880 2 8.321946 2 7.931763 24.044745 2 3.610412 Ar GEN 10 2 3 8.000000 1 8.317181 66.537451 3 13.124648 -24.100393 2 6.503132 2 18.910152 2 27.068139 53.040012 2 4.801263 2 8.015534 2 11.135735 28.220208 2 4.126631 K GEN 10 2 4 9.000 1 7.27386331637373 65.46476984736357 3 11.1729834540799 -10.84433558416271 2 7.70617523948938 -15.96316084113368 2 5.62491694962345 2 11.86687269408012 2 11.4425076498453 90.07677060151201 2 6.53712447768095 2 11.53420167311457 2 9.63121897030662 27.72023517356577 2 4.50881062128081 Ca GEN 10 2 4 10.000 1 7.041331745291820 70.41331745291820 3 14.01444871170631 -92.87298019372959 2 13.76936244330539 -5.753568238854550 2 4.717259669813990 2 149.3026232361631 2 11.24016734279034 23.75932943609596 2 5.353611600469730 2 99.20411436357747 2 13.06654848325639 13.45216129084917 2 4.027484971490170 Sc GEN 10 2 4 11.00000000 1 16.02394388 176.26338271 3 14.08647403 -83.68149599 2 11.93985121 0.43282764 2 3.69440111 2 153.96530175 2 11.49466541 14.93675657 2 5.01031394 2 97.21725690 2 11.45126730 10.81704018 2 4.76798446 Ti GEN 10 2 4 12.00000000 1 18.41366202 220.96394426 3 15.92292414 -94.29025824 2 13.65000623 0.09791142 2 5.09555210 2 173.94657235 2 12.70580613 18.83768333 2 6.11178551 2 111.45672882 2 12.64091929 11.17702682 2 5.35437415 V GEN 10 2 4 13.00000000 1 20.32168914 264.18195885 3 19.59698040 -115.29293208 2 17.33147348 -0.66288726 2 5.12320657 2 195.56713891 2 15.12502150 22.88642834 2 6.29898914 2 126.42119500 2 15.93855113 16.03597127 2 5.74006266 Cr GEN 10 2 4 14.00000000 1 18.28091074 255.93275041 3 17.09800655 -132.01826317 2 16.72267276 -0.77388761 2 5.02865105 2 219.48146209 2 16.90078760 28.07933176 2 7.33662150 2 139.98396871 2 17.31974516 19.54835786 2 6.92409757 Mn GEN 10 2 4 15.00000000 1 21.91937433 328.79061500 3 21.35527127 -162.05172805 2 21.27162653 -1.82694272 2 7.93913962 2 244.66870492 2 18.92044965 33.54162717 2 8.32764757 2 162.35033685 2 20.17347020 24.17956695 2 7.80047874 Fe GEN 10 2 4 16.00000000 1 23.22091713 371.53467417 3 23.54714679 -181.22603445 2 23.47256344 -2.37305236 2 9.85238815 2 277.50032547 2 22.21062697 46.20495585 2 9.51515800 2 194.99875056 2 24.57000871 31.67945132 2 8.86648776 Co GEN 10 2 4 17.00000000 1 25.00124115 425.02109971 3 22.83490096 -195.48211282 2 23.47468155 -2.81572866 2 10.33794825 2 271.77708486 2 23.41427030 54.26461121 2 10.76931694 2 201.53430745 2 25.47446316 38.99231927 2 10.68404901 Ni GEN 10 2 4 18.000 1 2.82630001015327e+01 508.7340018275886 3 2.69360254587070e+01 -2.20099999296390e+02 2 2.70860075292970e+01 -2.13493270999809e+00 2 1.22130001295874e+01 2 3.21240002430625e+02 2 2.64320193944270e+01 6.03470084610628e+01 2 1.17489696842121e+01 2 2.36539998999428e+02 2 2.94929998193907e+01 4.43969887908906e+01 2 1.15569831458722e+01 Cu GEN 10 2 4 19.00000000 1 31.53811263 599.22413997 3 31.06925531 -244.68915484 2 30.59035868 -1.29349525 2 14.05141063 2 370.71371824 2 29.35562242 66.27560813 2 12.77235919 2 271.66281028 2 33.51694543 49.76265057 2 12.52471484 Zn GEN 10 2 4 20.00000000 1 35.80797616 716.15952323 3 34.53646083 -204.68393323 2 28.62830178 0.76026614 2 7.96239682 2 431.70804302 2 35.02141356 95.87640437 2 14.63498691 2 313.57770563 2 42.22979234 74.01270048 2 14.57429304 Ga GEN 28 3 4 3.0 1 17.00473938158134 51.01421814474402 3 14.99961796477555 -39.00062591247301 2 11.99279249750992 35.44659356093000 2 14.99282276192415 2 21.78930966695012 2 1.85781132082231 -2.86685089713932 2 0.91950586478827 2 18.63985979160424 2 1.92030166263971 -1.63369679761927 2 1.00895888918239 2 2.03523714898590 2 0.62750876923831 -0.08532375682035 2 0.32619029984635 Ge GEN 28 3 4 4.0 1 1.478962662442 5.9158506497680 3 3.188905647765 -12.033712959815 2 1.927438978253 1.283543489065 2 1.545539235916 2 43.265429324814 2 2.894473589836 -1.909339873965 2 1.550339816290 2 35.263014141211 2 2.986528872039 0.963439928853 2 1.283381203893 2 2.339019442484 2 1.043001142249 0.541380654081 2 0.554562729807 As GEN 28 3 4 5.0 1 1.28593131534589 6.429656576729450 3 9.93487432688877 -15.01243900647766 2 1.89568153750512 2.89881363078702 2 1.72825641453405 2 75.65519437230579 2 3.47938697518409 -3.31145348709338 2 1.63747973017064 2 67.96186740640852 2 3.22936389274538 -3.09455795155570 2 1.66636575135787 2 24.30473448724631 2 2.06816256325470 0.93945624468575 2 1.54699940726544 Se GEN 28 3 4 6.0 1 2.97705189898323 17.862311393899380 3 7.01667360591764 -20.00913150638712 2 3.96066255032528 10.00573531473560 2 5.02826321004214 2 71.37928031464314 2 4.17536331935161 0.42619859321245 2 2.14491059745542 2 50.94828961394475 2 4.28772186507645 5.54288117697892 2 2.09538253707367 2 6.20469719059516 2 1.39403720595047 0.53395702862692 2 1.69659923150419 Br GEN 28 3 4 7.00000000000000 1 3.665770450000000 25.6603931500000 3 5.293022720000000 13.0402619252684 2 3.176376149835153 -21.908838668870 2 2.897543523376016 2 85.8843473075379 2 4.971806723636273 4.62125463404037 2 2.042687217782981 2 55.3617154916148 2 4.711839367430644 11.0314096124871 2 2.384292508891309 2 26.4104098578207 2 3.412863477885576 5.46873883641966 2 1.530284946887900 Kr GEN 28 3 4 8.0 1 10.79423805030976 86.353904402478080 3 13.32338941541937 -11.11453291523170 2 9.292050205053670 10.22951903851239 2 20.14895793077237 2 92.88955174083402 2 5.49072858263344 12.92947788650997 2 3.86301190150576 2 43.09952401633328 2 4.03857692489950 9.50975957670500 2 3.30678898758958 2 17.80494496367218 2 4.21348003421066 4.58911494794530 2 1.54989721316990