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1.345605 22.555725 19.326898 29.225893 19.436089 72.040522 27.163190 30.224346 25.038721 166.374712 99.771199 17.929008 82.106278 173.046548 167.886621 53.808512 50.051783 253.068760 94.865744 38.244674 34.368525 377.263977 36.571387 93.062425 27.085278 63.305147 607.388082 162.687565 42.054048 349.878508 392.480222 1024.660987 3968.338893 3144.028005 4170.392851 4879.341447 1185.814404 2163.556538 403.488381 983.247485 232.028259 35.158179 304.452591 376.435567 608.953388 1634.127036 1302.186828 844.518335 586.750215 137.476125 458.516279 443.719822 268.613660 162.601274 103.020349 89.764941 254.505493 55.993320 398.977546 130.981241 337.252688 311.795815 1043.144317 1357.404197 1.000000 298.150000 56258.2488 57061.1125 62646.1858 1 NOSYM 298.15 48.222 40.527 220.357 309.106 0.889 0.889 133.367 135.145 2.981 2.981 215.562 221.524 1710.2903609999973 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195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -6.559 -6.539 -6.483 -6.468 -6.447 -6.385 -6.350 -6.299 -6.146 -6.135 -3.826 -3.748 -3.552 -3.469 -3.305 -3.243 -3.227 -3.165 -3.014 -2.985 A A A A A A A A A A A A A A A A A A A A 0.00000000088536 0.00038725187255 0.00017384868373 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 Mo P Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H 2.3232 2.1272 2.3438 2.3259 2.2668 2.3271 2.3163 2.3276 2.2563 2.3186 2.3068 2.3047 -1.0380 -0.9972 -1.0372 -1.0465 -0.9025 -0.9202 -0.8540 -0.8977 -0.7335 -0.9085 -0.9289 -0.8923 -0.8999 -0.9002 -0.9087 -0.8456 -0.8921 -0.9213 -0.9056 -0.9130 -0.9077 -0.8906 -0.9062 -0.7088 -0.7542 -0.9013 -0.9075 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0.0247 0.0257 0.0273 0.0275 0.0277 0.0267 0.0307 0.0275 0.0288 0.0279 0.0281 0.0285 0.0283 0.0283 0.0322 0.0291 0.0267 0.0283 0.0276 0.0334 0.0334 0.0332 0.0332 0.0318 0.0337 0.0324 0.0336 0.0312 0.0335 0.0333 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 Mo P Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H 3.176358 1.999133 3.179585 3.181371 3.151362 3.179985 3.163014 3.189539 3.157837 3.176885 3.176048 3.170533 -1.129369 -1.066796 -1.128065 -1.141051 -1.179621 -1.181530 -1.126292 -1.173180 -0.729404 -1.183748 -1.194104 -1.169235 -1.171278 -1.168763 -1.187239 -0.910399 -1.149240 -1.167021 -1.167437 -1.167220 -1.167588 -1.140852 -1.164080 -0.977364 -0.712185 -1.155804 -1.158855 -1.161744 -0.982820 -0.988440 -0.980299 -0.986911 -1.011666 -0.979478 -1.002605 -0.971498 -1.009203 -0.980739 -0.987944 0.048653 0.060764 2.387088 1.559063 2.388883 2.384761 2.346260 2.386762 2.378150 2.374434 2.368096 2.386772 2.384789 2.356281 -0.896512 -0.841485 -0.896705 -0.908586 -0.904859 -0.929811 -0.897525 -0.914609 -0.812997 -0.911743 -0.903302 -0.911564 -0.912551 -0.908847 -0.907807 -0.730985 -0.930390 -0.918357 -0.920055 -0.937892 -0.930715 -0.908902 -0.932330 -0.757574 -0.831724 -0.937297 -0.934602 -0.932129 -0.741290 -0.736493 -0.741619 -0.752185 -0.777279 -0.741375 -0.763440 -0.722136 -0.790183 -0.741059 -0.750012 0.302568 0.315018 2.467295 1.549898 2.469768 2.470562 2.418966 2.471876 2.451835 2.507467 2.446968 2.469925 2.469068 2.457459 -0.899375 -0.893437 -0.906159 -0.919449 -0.992318 -1.006942 -0.949070 -0.985977 -0.882701 -1.000041 -1.004625 -0.973593 -0.976340 -1.029914 -0.986264 -0.847258 -0.967987 -0.964840 -0.973776 -0.987586 -0.967650 -0.960298 -0.975213 -0.744550 -0.900332 -0.975630 -0.991624 -0.983313 -0.698335 -0.715612 -0.697613 -0.709752 -0.736390 -0.695404 -0.721678 -0.705882 -0.775136 -0.696439 -0.711329 0.406800 0.451948 1.69655794 -1.53727170 -0.16673950 2.29549889 -12.14563792 5.23745221 -6.09247551 9.41202012 9.37022922 2.73361781 -326.9927 403.0524 -145.4092 -342.3998 -29.5633 -441.3125 Feb13-2023 12:42:46 Nodes: 1 Procs: 1 Feb13-2023 12:42:47 Nodes: 1 Procs: 1 0 Feb13-2023 12:42:47 Nodes: 1 Procs: 1 Feb13-2023 12:42:47 Nodes: 1 Procs: 1 Phosphorus (TZP, 1s frozen) 0 Feb13-2023 12:42:48 Nodes: 1 Procs: 1 Feb13-2023 12:42:49 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Feb13-2023 12:42:50 Nodes: 1 Procs: 1 Feb13-2023 12:42:50 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Feb13-2023 12:42:51 Nodes: 1 Procs: 24 *** (NO TITLE) *** -5 -15.57678716 -15.98869031 -15.62329119 -16.05707593 -16.16464893 -16.18330154 -16.18998613 -16.19261876 -16.19467719 -16.20062222 -16.20556929 -16.20837855 -16.21029571 -16.21274438 -16.21443499 -16.21488862 -16.21520810 -16.21551123 -16.21572809 -16.21586884 -16.21601494 -16.21613869 -16.21624935 -16.21636059 -16.21650209 -16.21667520 -16.21678417 -16.21717522 -16.21727417 -16.21743795 -16.21762482 -16.21767614 -16.21777098 -16.21781696 -16.21784251 -16.21786842 -16.21789067 -16.21790609 -16.21791937 -16.21792317 -16.21792380 -16.21792893 -16.21793672 GEOMETRY CONVERGED