AMS 2023.101 r111868 2023-03-31 2023-05-28T13:30:30.000 GEOMETRY OPTIMIZATION FREQUENCIES DFT Becke88 Perdew86 Becke88 Perdew86 480.230325 AuxInfo=1/0/N:63,17,47,22,23,52,53,60,3,9,33,39,2,11,32,41,6,36,1,31,21,51,30;68,72;69,71;70,73;67/E:(2,3)(4,5,6,7)(9,10,11,12)(13,14,15,16)(17,18)(19,20)(21,22);;;;/CRV:;3*1.1,2.1;/rA:73CCCHHCHHCHCHHHHHCHHHCCCHHHHHHP4CCCHHCHHCHCHHHHHCHHHCCCHHHHHHCHHCHHHNiC2C2C2O1O1O1/rB:s1;s2;s2;s2;s3;s3;s3;s6;s6;s1s9;s9;s9;s11;s11;s1;s6;s17;s17;s17;s1;s21;s21;s23;s23;s23;s22;s22;s22;s21;;s31;s32;s32;s32;s33;s33;s33;s36;s36;s31s39;s39;s39;s41;s41;s31;s36;s47;s47;s47;s30s31;s51;s51;s53;s53;s53;s52;s52;s52;s30;s60;s60;s60;s63;s63;s63;s30;s67;s67;s67;s69;s68;s70;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;; VWN Restricted Restricted 0.00000 1.0E-08 1000 conjugate-gradient 7.58000 3.18000 1 3 1417.98155631 3939.42642280 Tetrahydrofuran DFT VWN Restricted Restricted Point Charge Nuclei Frozen Orbital(s) System Atoms C 1.0119309501 1.7939780776 -0.7630195833 C 1.9949817798 2.8035053896 -1.3722682616 C 3.0517022135 3.2068795951 -0.3432595205 H 2.5166417896 2.3746550456 -2.2270283890 H 1.4612267129 3.6901152410 -1.7157971476 C 2.4566100556 3.7986699972 0.9369441998 H 3.6348285830 2.3211998928 -0.0765274867 H 3.7381872458 3.9275463941 -0.7939485157 C 1.4045294117 2.8360047308 1.4948971000 H 3.2631195435 3.8832278706 1.6765370427 C 0.3602440233 2.4600038220 0.4486782532 H 1.9033986770 1.9273366947 1.8423784110 H 0.9103250688 3.2889843962 2.3580987752 H -0.3635676480 1.7740612219 0.9016103349 H -0.1809514611 3.3554777981 0.1450405909 H 1.6094415056 0.9599249676 -0.3902610603 C 1.8975501881 5.2036490001 0.7171823451 H 1.0941198065 5.2063703487 -0.0133459271 H 1.5076939580 5.6031659043 1.6513616428 H 2.6824501001 5.8688952820 0.3627564763 C -0.0194813957 1.2213850529 -1.7752840460 C 0.6622690391 0.8955161788 -3.1069521402 C -1.1243368229 2.2444069579 -2.0531062867 H -1.8174184608 2.3112698466 -1.2154200642 H -0.6887466814 3.2277088125 -2.2146095103 H -1.6777732038 1.9796957056 -2.9497035696 H 0.0207606627 0.2930991081 -3.7429215698 H 1.6009676367 0.3703755886 -2.9596329897 H 0.8676291503 1.8211363147 -3.6404012202 P -0.8934364872 -0.3329375708 -1.0591841536 C 1.6243357468 -1.7099128004 -0.7181510918 C 1.6198369932 -1.4340334418 0.7844466802 C 3.0148216480 -1.0735476835 1.2859378202 H 0.9329770611 -0.6110805994 1.0031362155 H 1.2617671378 -2.3112427107 1.3231575379 C 4.0326808544 -2.1829434284 1.0064707415 H 3.3499735806 -0.1586525460 0.7893269293 H 2.9760979445 -0.8695896580 2.3588192322 C 3.9848200919 -2.5471523729 -0.4800256756 H 5.0324752057 -1.7865724521 1.2252674403 C 2.5768024995 -2.8880407463 -0.9691641972 H 4.3619964649 -1.6999804292 -1.0591842061 H 4.6473105686 -3.3949496930 -0.6690051475 H 2.6403605846 -3.1187132545 -2.0317472609 H 2.2198332914 -3.7783585214 -0.4519995780 H 2.0664955438 -0.8439951661 -1.2215075577 C 3.8240880622 -3.3994613988 1.9070850931 H 4.5864353558 -4.1498278279 1.7072732517 H 3.8971526458 -3.1092762834 2.9534362906 H 2.8503847029 -3.8539932570 1.7499042169 C 0.2040841026 -1.9046313097 -1.3119025313 C -0.5503325582 -3.0171995605 -0.5766231660 C 0.3334872199 -2.3244767384 -2.7835254161 H 0.6054830102 -3.3773459461 -2.8217168654 H -0.5968491706 -2.2228246795 -3.3299158869 H 1.1029739025 -1.7593185249 -3.2976431928 H 0.0371353237 -3.9318328580 -0.5618561544 H -1.4935043945 -3.2410822079 -1.0723708959 H -0.7682199221 -2.7325050031 0.4532384483 C -2.2210839100 -0.6541756785 -2.3277573593 H -1.8559264020 -0.3611864908 -3.3137430704 H -2.3708273134 -1.7365336221 -2.3177123193 C -3.5848883652 -0.0136312612 -2.0911524850 H -3.9751309010 -0.2848639946 -1.1098721565 H -4.2851026222 -0.3794907894 -2.8410718971 H -3.5553226709 1.0691893067 -2.1555973816 Ni -2.1125344568 -0.2419990683 1.0818174888 C -3.0228349492 1.3066529626 1.0355058520 C -3.1648366841 -1.6975777159 0.9793791318 C -0.9958479773 -0.3421358477 2.4918636446 O -3.8424919949 -2.6162954965 0.9517978847 O -3.6440862166 2.2643496196 1.0710740995 O -0.4561204563 -0.4026495240 3.4957360919 End End Task GeometryOptimization GeometryOptimization CalcPropertiesOnlyIfConverged Yes End UseSymmetry False Properties PESPointCharacter Yes End Engine ADF Basis Type TZ2P Core Small End XC GGA BP86 dispersion Grimme3 BJDAMP End Relativity Level Scalar End NumericalQuality Good Solvation Solv name=Tetrahydrofuran cav0=0.0 cav1=0.0067639 Charged method=CONJ C-Mat POT SCF VAR LAST End EndEngine 12.00000000 12.00000000 12.00000000 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 12.00000000 1.00782500 12.00000000 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 1.00782500 12.00000000 12.00000000 12.00000000 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 30.97376100 12.00000000 12.00000000 12.00000000 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 12.00000000 1.00782500 12.00000000 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 1.00782500 12.00000000 12.00000000 12.00000000 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 12.00000000 1.00782500 1.00782500 1.00782500 57.93534700 12.00000000 12.00000000 12.00000000 15.99491400 15.99491400 15.99491400 C C C H H C H H C H C H H H H H C H H H C C C H H H H H H P C C C H H C H H C H C H H H H H C H H H C C C H H H H H H C H H C H H H Ni C C C O O O NOSYM 0 SCF CONVERGED 480.230325 AuxInfo=1/0/N:63,17,47,22,23,52,53,60,3,9,33,39,2,11,32,41,6,36,1,31,21,51,30;68,72;69,71;70,73;67/E:(2,3)(4,5,6,7)(9,10,11,12)(13,14,15,16)(17,18)(19,20)(21,22);;;;/CRV:;3*1.1,2.1;/rA:73CCCHHCHHCHCHHHHHCHHHCCCHHHHHHP4CCCHHCHHCHCHHHHHCHHHCCCHHHHHHCHHCHHHNiC2C2C2O1O1O1/rB:s1;s2;s2;s2;s3;s3;s3;s6;s6;s1s9;s9;s9;s11;s11;s1;s6;s17;s17;s17;s1;s21;s21;s23;s23;s23;s22;s22;s22;s21;;s31;s32;s32;s32;s33;s33;s33;s36;s36;s31s39;s39;s39;s41;s41;s31;s36;s47;s47;s47;s30s31;s51;s51;s53;s53;s53;s52;s52;s52;s30;s60;s60;s60;s63;s63;s63;s30;s67;s67;s67;s69;s68;s70;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;; 0.004251 24349.57518700 950.94442400 26283.88200283 26.83923523 41.73078851 C C C H H C H H C H C H H H H H C H H H C C C H H H H H H P C C C H H C H H C H C H H H H H C H H H C C C H H H H H H C H H C H H H Ni C C C O O O -0.02723778 -0.01175259 0.04634522 0.06054254 -0.09281831 0.05812656 0.04260573 -0.13190500 0.09286133 0.07161780 -0.14842478 0.09177624 0.12800679 -0.07130042 0.00868735 0.02782483 -0.06838636 0.05851383 -0.01942252 -0.16115647 0.13516434 0.10293552 -0.18339788 0.10446554 -0.06798220 0.01985528 0.03455307 0.00359776 -0.11482033 0.09112940 -0.04783549 0.07479852 -0.00631232 -0.15026720 -0.01019820 0.07894672 -0.07461108 0.07587108 0.00371299 -0.12742080 0.14530990 -0.02387824 0.03981513 0.11149271 -0.06372949 -0.09033343 -0.02984798 0.11465412 0.14122970 -0.02983780 0.00616842 0.17657330 0.01987897 -0.03372255 0.12776415 0.01541047 -0.01821609 0.20918245 -0.09452727 0.02875814 -0.01296358 0.00440415 0.01977725 -0.00669302 0.02096159 0.01962444 -0.00777881 0.00993060 0.02201113 -0.00776965 0.00680707 0.02318462 -0.00077725 0.00862962 0.02973437 -0.00766370 0.01730754 0.01930628 -0.01702362 0.05340355 0.00330884 -0.02323244 -0.00695529 0.01031582 0.01990970 0.02671665 0.04429778 -0.00859047 -0.00292704 -0.00051131 -0.00191882 0.00586342 -0.00933846 -0.00762008 -0.06603552 0.00976023 -0.01541771 -0.05537143 0.02547439 -0.03171399 -0.09464242 0.05180386 0.01313410 -0.10415763 -0.03000181 0.01095959 -0.01959036 -0.03410118 -0.03637653 -0.02034659 0.07023238 -0.02044256 -0.11048299 0.03891039 0.01764745 0.05438118 -0.05437737 0.00240037 -0.00632325 -0.01730140 0.02586712 0.04148245 -0.07048191 -0.00511445 0.09530597 -0.01277682 0.03933484 0.08099306 -0.09922348 0.03538751 0.09782295 -0.08336253 0.04787087 0.00453017 -0.11737108 -0.02220911 0.04128043 0.02971771 0.04155671 -0.07321009 -0.09413786 0.05238091 -0.05219712 -0.14298494 0.04734825 -0.12632947 -0.07870414 0.04794572 -0.08297379 -0.10676626 -0.00169512 0.00294002 -0.01111117 0.00502322 -0.00323826 -0.01457761 -0.00523825 0.01058427 -0.01340553 0.00657292 0.01548047 -0.01750899 -0.00607712 0.00019257 -0.01068870 -0.01574745 0.01949695 -0.01548608 0.02260159 0.00574178 -0.00135850 0.01486652 -0.02060823 -0.02923001 -0.01320217 -0.00105180 -0.01754501 -0.00672468 -0.00251261 -0.00035805 -0.00439602 0.00815715 0.00309287 -0.00403125 -0.00298553 -0.01012606 -0.00839286 -0.01005607 0.00553639 -0.01413841 -0.03916777 -0.00639780 -0.00132768 0.01113957 -0.00770712 -0.00921429 -0.00994729 0.03537721 -0.01044415 0.02036415 -0.00394693 -0.12039812 -0.04815584 -0.06918368 0.06962117 -0.04860401 0.05566418 0.00529987 0.19180051 -0.00964240 0.11685140 -0.08693773 0.08158527 -0.20425744 -0.10067994 -0.10736283 0.02720497 0.32768314 -0.01406133 0.00385883 0.01209380 0.02360189 0.01718815 -0.00380114 0.01742771 -0.03033040 0.07773666 0.03604160 0.05904149 -0.04576908 0.06152302 0.01776190 -0.03166674 -0.05573031 -0.09756668 0.13712878 -0.02043930 -0.01806023 0.10566227 0.11214535 -0.03071566 0.06836189 0.02082971 -0.06314148 0.11461524 0.00112842 -0.12410568 0.22596504 0.00116027 -0.03026024 0.03516304 -0.00386703 -0.02625120 0.14794099 0.04108804 -0.09787536 0.12540573 -0.02208623 -0.01067121 0.02392236 0.00833536 -0.06006717 0.00437489 -0.04019845 -0.00876121 0.01283329 0.05313122 -0.16565419 0.09605062 -0.12873080 -0.13645120 0.01020290 -0.16483423 -0.22709743 0.13295729 -0.16816097 -0.18591429 0.11465572 -0.13643384 0.01967542 0.00497844 0.00750101 0.03530555 0.01019794 0.01444006 0.01545252 -0.00308769 -0.01111395 0.00351585 -0.00312998 -0.02064599 0.00790045 0.00053091 -0.01240727 0.02745905 -0.01453238 -0.01628411 0.04061733 0.01309853 0.00636111 0.03290294 0.00916670 0.02259394 0.04037719 0.01196035 0.02025082 0.01831135 0.00379892 -0.00419372 0.00567348 -0.00948882 -0.00923990 -0.01528188 -0.05018190 0.00099177 -0.01782825 -0.10858445 0.04936271 0.00907556 -0.03296563 0.00186720 -0.05990461 -0.04908404 -0.02696613 -0.05220929 -0.13718488 0.04110786 0.02759581 -0.10350789 0.08586103 -0.04063854 -0.14071146 0.05678302 -0.00959046 -0.06389973 0.01992861 -0.04485738 -0.18859293 0.10152388 -0.00138476 -0.00872548 -0.04155535 0.03141310 -0.04297667 0.07412602 -0.02439532 -0.07151588 0.00038150 0.02499144 0.05010244 -0.05428711 -0.03006939 -0.03284153 -0.10250591 0.01154628 0.01112152 0.02433665 -0.14114153 -0.17331022 -0.02585346 -0.16949902 -0.19776478 -0.03629779 -0.16673733 -0.22828010 -0.00755816 -0.15529494 -0.12306382 -0.08538772 0.01015346 0.00607140 -0.02872477 -0.00592186 -0.00495575 -0.05922543 0.02109763 0.03157103 -0.03600060 -0.00211985 0.02291249 -0.04971565 0.02772147 0.06349916 -0.05066812 0.04352771 0.02694314 -0.01421084 -0.01359764 -0.00814862 -0.07188875 -0.00251183 0.01068442 -0.07493591 -0.01743288 -0.02605684 -0.05610127 0.01255335 0.02671477 -0.00322713 0.00754134 0.05827620 0.00188219 0.01808474 0.02534879 -0.03510986 0.01092602 0.01496418 0.02688876 0.02175168 -0.01462547 0.02272911 0.00459456 0.03628092 0.02426744 0.00657375 0.01502902 0.05771737 0.03849028 -0.00577133 0.00834740 0.04151116 -0.00442943 0.00956975 0.04432515 -0.01222783 0.03826185 0.05191361 0.01259210 -0.00057460 0.04608008 -0.01448961 0.06492135 0.05291576 0.00273076 0.00901924 0.05663746 0.02707026 -0.00258353 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 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 C C C H H C H H C H C H H H H H C H H H C C C H H H H H H P C C C H H C H H C H C H H H H H C H H H C C C H H H H H H C H H C H H H Ni C C C O O O 0.08420810 0.15503972 0.15751242 -0.07768812 -0.08010601 0.11221999 -0.08219475 -0.07728227 0.15648919 -0.08132875 0.14173509 -0.08203688 -0.07734394 -0.13116680 -0.08176630 -0.09489003 0.20615998 -0.07613198 -0.07270865 -0.07331368 -0.16108949 0.19654733 0.18977803 -0.08225724 -0.06499215 -0.06971400 -0.07280269 -0.06808744 -0.06490767 1.05172809 0.08826568 0.14545038 0.15789462 -0.10835383 -0.07758938 0.11267041 -0.08293215 -0.07475847 0.15747446 -0.08033389 0.15522906 -0.08088169 -0.07661061 -0.07594837 -0.07921984 -0.08958198 0.20652563 -0.07255858 -0.07196547 -0.07542113 -0.15733346 0.17938889 0.19355035 -0.06674864 -0.07381493 -0.07140345 -0.06608995 -0.07531229 -0.09385454 -0.07824720 -0.07337186 -0.07393332 0.19769596 -0.09034334 -0.06476339 -0.07343112 0.57608109 -0.06135255 -0.06231622 -0.05310897 -0.22309559 -0.22333039 -0.22182903 0.06013527 0.13759020 0.12905808 -0.05304981 -0.05907540 0.08649521 -0.06406208 -0.06139263 0.13332642 -0.05943198 0.13016275 -0.06144083 -0.05828098 -0.13926944 -0.05879731 -0.07389455 0.16872979 -0.06552372 -0.05917792 -0.06069920 -0.16431047 0.16409209 0.15135729 -0.06445950 -0.01280342 -0.04668933 -0.05152676 -0.04304919 -0.01919378 0.57629688 0.06519299 0.12202491 0.13326420 -0.10117686 -0.05946043 0.08552472 -0.06262849 -0.05363915 0.12901256 -0.05839825 0.13593954 -0.06422129 -0.05973626 -0.04958298 -0.05726116 -0.06757813 0.16815678 -0.05960400 -0.05822208 -0.06447879 -0.15958035 0.14217348 0.16453492 -0.02161329 -0.05017058 -0.04685926 -0.00139112 -0.05712222 -0.09265886 -0.22753430 0.05337039 0.03073656 0.18094340 -0.08151756 0.00255393 -0.05780247 0.32637467 -0.02294811 -0.02805291 -0.01851926 -0.17157433 -0.17368570 -0.17390055 0.07312883 0.13896345 0.13505124 -0.05378840 -0.06269626 0.09859320 -0.07208260 -0.06026108 0.13329938 -0.06278863 0.12749670 -0.07369767 -0.05154065 -0.13338853 -0.06332763 -0.08371591 0.18530239 -0.07024625 -0.06681859 -0.06600879 -0.14417829 0.16379374 0.13330021 -0.05137903 -0.01852937 -0.03937164 -0.05618607 -0.03337347 -0.02967566 0.57177947 0.07406074 0.12705195 0.14137257 -0.11074064 -0.06027024 0.10816608 -0.07375842 -0.05206030 0.13778704 -0.06870876 0.14105254 -0.07211538 -0.06517121 -0.04915890 -0.05918892 -0.07361847 0.16997113 -0.05992895 -0.06184635 -0.07119112 -0.14290813 0.12154621 0.16821818 -0.03227214 -0.05702239 -0.04322279 -0.01080777 -0.04921553 -0.07466516 -0.21427179 0.04112189 0.05107545 0.15728815 -0.07939876 0.00489727 -0.05290395 0.34786072 -0.04587347 -0.03889482 -0.03133017 -0.17334500 -0.16430510 -0.17092942 -298.504994 386.885325 -131.437799 -367.172818 -0.089662 -5.166685 -415.486631 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 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 C C C H H C H H C H C H H H H H C H H H C C C H H H H H H P C C C H H C H H C H C H H H H H C H H H C C C H H H H H H C H H C H H H Ni C C C O O O 0.21493019 0.35001434 0.33712651 -0.19621392 -0.19643989 0.14927972 -0.16188039 -0.19568486 0.34416721 -0.14412803 0.37308663 -0.15977439 -0.20352977 -0.10813803 -0.19801190 -0.01820901 0.51826435 -0.17133508 -0.20213423 -0.20396474 -0.27087947 0.58335853 0.56569703 -0.17092942 -0.21762325 -0.20942271 -0.20748522 -0.18968196 -0.21655961 1.14856329 0.21781325 0.36945913 0.35600486 -0.10072948 -0.17896974 0.14809822 -0.16740873 -0.19539180 0.32348045 -0.13369026 0.36024857 -0.18679333 -0.19352015 -0.18552829 -0.17788763 -0.12332755 0.52015077 -0.20637786 -0.19777729 -0.17620000 -0.25505144 0.56981544 0.58184432 -0.20802718 -0.19499141 -0.18456519 -0.22372267 -0.18574845 -0.20261972 0.11639029 -0.17057972 -0.16145447 0.49972593 -0.17872279 -0.22032681 -0.16224815 -0.29756354 0.38245641 0.38042158 0.37944832 -0.42417570 -0.42757178 -0.42684835 -6.90942359 -0.87657904 8.38737579 2.53737911 1.74202498 4.37204448 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 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744 745 746 747 748 749 750 751 752 753 754 755 756 757 758 759 760 761 762 763 764 765 766 767 768 769 770 771 772 773 774 775 776 777 778 779 780 781 782 783 784 785 786 787 788 789 790 791 792 793 794 795 796 797 798 799 800 801 802 803 804 805 806 807 808 809 810 811 812 813 814 815 816 817 818 819 820 821 822 823 824 825 826 827 828 829 830 831 832 833 834 835 836 837 838 839 840 841 842 843 844 845 846 847 848 849 850 851 852 853 854 855 856 857 858 859 860 861 862 863 864 865 866 867 868 869 870 871 872 873 874 875 876 877 878 879 880 881 882 883 884 885 886 887 888 889 890 891 892 893 894 895 896 897 898 899 900 901 902 903 904 905 906 907 908 909 910 911 912 913 914 915 916 917 918 919 920 921 922 923 924 925 926 927 928 929 930 931 932 933 934 935 936 937 938 939 940 941 942 943 944 945 946 947 948 949 950 951 952 953 954 955 956 957 958 959 960 961 962 963 964 965 966 967 968 969 970 971 972 973 974 975 976 977 978 979 980 981 982 983 984 985 986 987 988 989 990 991 992 993 994 995 996 997 998 999 1000 1001 1002 1003 1004 1005 1006 1007 1008 1009 1010 1011 1012 1013 1014 1015 1016 1017 1018 1019 1020 1021 1022 1023 1024 1025 1026 1027 1028 1029 1030 1031 1032 1033 1034 1035 1036 1037 1038 1039 1040 1041 1042 1043 1044 1045 1046 1047 1048 1049 1050 1051 1052 1053 1054 1055 1056 1057 1058 1059 1060 1061 1062 1063 1064 1065 1066 1067 1068 1069 1070 1071 1072 1073 1074 1075 1076 1077 1078 1079 1080 1081 1082 1083 1084 1085 1086 1087 1088 1089 1090 1091 1092 1093 1094 1095 1096 1097 1098 1099 1100 1101 1102 1103 1104 1105 1106 1107 1108 1109 1110 1111 1112 1113 1114 1115 1116 1117 1118 1119 1120 1121 1122 1123 1124 1125 1126 1127 1128 1129 1130 1131 1132 1133 1134 1135 1136 1137 1138 1139 1140 1141 1142 1143 1144 1145 1146 1147 1148 1149 1150 1151 1152 1153 1154 1155 1156 1157 1158 1159 1160 1161 1162 1163 1164 1165 1166 1167 1168 1169 1170 1171 1172 1173 1174 1175 1176 1177 1178 1179 1180 1181 1182 1183 1184 1185 1186 1187 1188 1189 1190 1191 1192 1193 1194 1195 1196 1197 1198 1199 1200 1201 1202 1203 1204 1205 1206 1207 1208 1209 1210 1211 1212 1213 1214 1215 1216 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 2.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 -172.980563 -123.331038 -123.329645 -123.249703 -108.232725 -68.668479 -68.637871 -68.353313 -28.194937 -28.179998 -28.157303 -21.236448 -21.002960 -20.300017 -19.960848 -19.170172 -18.508957 -18.422473 -18.350225 -18.289756 -17.209008 -16.969904 -16.715456 -16.637114 -16.380209 -15.362086 -15.125675 -14.966722 -14.870877 -14.434885 -14.141669 -13.721490 -13.700437 -13.482158 -13.215454 -12.880200 -12.823200 -12.088199 -12.052537 -11.695224 -11.591793 -11.305965 -11.278303 -11.109905 -11.089109 -11.059977 -11.051889 -10.964526 -10.950874 -10.881383 -10.855748 -10.841432 -10.778003 -10.736735 -10.646343 -10.594595 -10.545724 -10.229736 -10.199056 -10.184061 -9.881650 -9.779417 -9.739463 -9.569410 -9.468757 -9.404981 -9.300298 -9.221234 -9.151110 -8.988600 -8.881486 -8.725604 -8.689215 -8.602963 -8.555128 -8.485466 -8.333668 -8.303232 -8.119269 -8.025502 -7.915148 -7.823480 -7.666380 -7.515999 -7.455343 -7.393352 -7.099524 -7.051577 -7.006471 -6.975455 -6.934747 -6.804165 -6.742554 -5.724194 -5.630753 -5.389164 -1.911630 -1.570967 -1.522329 -1.280379 -1.209614 -1.187132 -0.176221 -0.105174 0.148357 0.278295 0.329878 0.445535 0.557273 0.660538 0.850604 0.929316 0.986963 1.101286 1.281612 1.339694 1.380968 1.434408 1.501004 1.540847 1.645148 1.808678 1.886436 2.001639 2.039981 2.099151 2.144986 2.168104 2.321315 2.374404 2.539447 2.617086 2.720441 2.795836 2.844105 3.012058 3.138279 3.219711 3.272013 3.366390 3.408097 3.431370 3.564347 3.672751 3.689738 3.815890 3.881409 3.923006 3.967586 4.029271 4.097271 4.206600 4.334956 4.356714 4.494254 4.536385 4.690413 4.795863 4.810210 4.881316 4.966131 5.011970 5.081324 5.135163 5.318465 5.401352 5.421862 5.444499 5.554724 5.623011 5.734432 5.765129 5.886528 5.962935 6.068859 6.111197 6.219749 6.322375 6.391949 6.495448 6.543654 6.640566 6.725827 6.796642 6.920019 7.075460 7.219444 7.282437 7.328897 7.474401 7.527825 7.776468 7.872971 7.933468 7.958776 8.062270 8.148286 8.220343 8.416512 8.486119 8.664510 8.772643 8.820091 8.954492 9.134134 9.233625 9.393734 9.432665 9.545349 9.610090 9.704083 9.806595 9.851272 10.126603 10.222182 10.284303 10.370224 10.454191 10.547469 10.592444 10.670542 10.747084 10.882853 10.894274 10.960911 11.141572 11.165565 11.290543 11.364970 11.448119 11.589004 11.680766 11.770978 11.837256 11.857536 11.969654 12.019689 12.113902 12.185909 12.367781 12.439301 12.567047 12.725686 12.739088 12.832075 12.929452 13.023034 13.041327 13.346987 13.449659 13.511980 13.671328 13.734360 13.755687 13.804142 13.839438 13.950625 14.039654 14.118538 14.314538 14.407759 14.477033 14.649469 14.681733 14.774945 14.850013 14.916680 14.974848 15.108536 15.188773 15.281176 15.400705 15.480789 15.631834 15.762213 15.994418 16.114953 16.130743 16.297802 16.375756 16.545704 16.665904 16.776738 16.988893 17.076839 17.276448 17.323013 17.552822 17.684460 17.724052 17.788243 18.011575 18.148622 18.425957 18.461080 18.712429 18.789516 18.995545 19.146269 19.293214 19.531220 19.760647 19.947116 20.193893 20.307972 20.554176 20.706295 20.871794 21.044216 21.223357 21.274548 21.538142 21.679164 21.797849 21.909169 22.254169 22.414052 22.522616 22.732339 22.816380 22.987704 23.071206 23.476424 23.599788 23.767183 23.959640 24.286227 24.394829 24.694415 24.800953 25.047976 25.185302 25.239499 25.350698 25.528452 25.786511 25.916150 26.063027 26.183833 26.230015 26.332017 26.367214 26.583334 26.847732 26.885907 26.981974 27.313095 27.399854 27.487889 27.571211 27.855182 27.929349 28.105920 28.190652 28.433924 28.496801 28.604776 28.717632 28.838626 29.159192 29.308933 29.477956 29.649796 29.794983 29.895996 29.949195 30.095189 30.195379 30.318413 30.463205 30.582680 30.710188 30.846264 30.930110 31.040628 31.096447 31.291633 31.338686 31.589116 31.782355 31.954544 32.155030 32.226230 32.303674 32.559465 32.591038 32.831566 32.929550 32.977939 33.016796 33.079426 33.362543 33.534362 33.563631 33.666419 33.835036 33.896839 34.056006 34.153672 34.226138 34.298791 34.446827 34.668364 34.782316 34.898238 35.027200 35.075073 35.158996 35.253435 35.293389 35.452358 35.535170 35.680284 35.746700 35.926031 36.099741 36.121847 36.307576 36.407928 36.511700 36.596219 36.705851 36.801620 36.923028 37.084130 37.213343 37.297873 37.420710 37.614428 37.621649 37.768180 37.836197 37.982139 38.168477 38.228926 38.409461 38.450611 38.669889 38.776664 38.926357 39.146263 39.320066 39.500127 39.572329 39.606232 39.759790 39.866764 39.939213 40.098199 40.249605 40.406393 40.742550 40.877900 40.967973 41.015880 41.090847 41.284703 41.341029 41.568574 41.696382 41.780938 41.979741 42.063042 42.197360 42.381698 42.397553 42.522342 42.705188 42.940516 43.317790 43.342444 43.596472 43.698526 43.822329 44.058525 44.167193 44.267266 44.387808 44.487288 44.707075 44.809521 44.980948 45.064593 45.093174 45.449465 45.616327 45.792122 45.967611 46.193861 46.292310 46.420452 46.516720 46.657472 46.700861 46.998302 47.141782 47.186916 47.457481 47.522813 47.912078 48.179752 48.313327 48.503919 48.646645 48.757370 49.046001 49.185095 49.257898 49.313894 49.474464 49.668949 49.826516 49.886563 49.984233 50.187866 50.309969 50.416970 50.535662 50.651883 50.807309 50.842833 51.023338 51.100962 51.302247 51.584089 51.625307 51.839306 52.026562 52.229031 52.457927 52.565645 52.677783 52.735095 52.893599 52.979686 53.197182 53.516350 53.596906 53.712986 53.896305 54.055502 54.315485 54.348084 54.573141 54.738543 54.777232 54.785441 55.000072 55.285624 55.434264 55.693715 55.806386 56.108100 56.219143 56.706024 56.796829 56.933838 57.018651 57.379031 57.529862 57.660860 57.812283 57.941027 58.048673 58.358265 58.616392 58.818857 58.927761 59.096265 59.300190 59.536247 59.680954 59.748201 59.852139 60.040163 60.168218 60.372689 60.550783 60.858506 61.014498 61.217827 61.339591 61.596769 61.863020 62.030059 62.218020 62.485153 62.650913 62.687834 62.922898 62.973101 63.218137 63.272531 63.602085 63.819182 63.937021 64.094303 64.257837 64.521946 64.726760 64.932471 65.189168 65.331079 65.453164 65.623650 65.739574 65.898730 66.400135 66.512095 66.790043 66.960630 67.200013 67.530871 67.643717 67.790401 67.882656 68.101380 68.182731 68.437587 68.491842 68.626983 68.853696 68.986168 69.332270 69.595718 69.717736 69.874729 70.095456 70.341841 70.347002 70.683865 70.748482 70.951640 71.313295 71.463498 71.547374 71.615960 71.780572 71.979303 72.126199 72.227180 72.423115 72.452081 72.543003 72.846301 72.928537 73.034577 73.142825 73.308132 73.576045 73.950423 73.985453 74.235895 74.353895 74.610992 75.103490 75.163894 75.438611 75.488726 75.611067 75.861728 75.960849 76.088966 76.225847 76.345005 76.649690 76.715322 76.796991 76.896756 76.987483 77.094682 77.304974 77.387813 77.569310 77.687179 77.779575 77.863704 78.156956 78.292531 78.443432 78.503571 78.665004 78.769244 78.841377 79.110256 79.143675 79.267564 79.382220 79.574830 79.713141 79.836148 79.978496 80.069598 80.342805 80.409574 80.569505 80.711103 80.910095 81.055823 81.263418 81.354124 81.610489 81.886598 82.044336 82.121954 82.174372 82.452865 82.650622 82.838079 82.923197 83.026105 83.213310 83.263977 83.457017 83.480004 83.745387 83.922513 84.262116 84.425420 84.463196 84.616508 84.720062 85.211237 85.265628 85.367328 85.557607 85.748559 85.851239 86.114917 86.246437 86.358811 86.370029 86.546268 86.738424 86.770701 86.935925 87.134804 87.404005 87.476123 87.633328 87.883832 88.235199 88.526091 88.677251 88.797373 88.917760 89.039675 89.102273 89.151674 89.287677 89.375418 89.546835 89.627413 89.803072 89.893253 90.108995 90.211193 90.385442 90.485705 90.557640 90.803976 90.941058 90.979361 91.291866 91.355855 91.611036 91.661715 91.866748 92.027589 92.090253 92.187079 92.290390 92.480172 92.741229 92.840568 92.886672 93.021478 93.283634 93.378733 93.591147 93.633079 93.774956 93.821212 93.955314 94.069053 94.286834 94.388251 94.673398 94.758939 94.839016 95.127438 95.173854 95.403820 95.668580 95.846024 95.888424 96.014885 96.102436 96.275401 96.350541 96.491696 96.740048 96.790525 96.823961 96.940558 97.155799 97.376970 97.450071 97.720543 97.978410 98.041938 98.152045 98.256257 98.412184 98.546275 98.693896 98.856624 98.960185 99.049539 99.185506 99.419665 99.521666 99.722601 99.855255 99.982533 100.111940 100.369604 100.571041 100.599806 100.666049 100.928565 101.059904 101.300862 101.547479 101.719195 101.920943 102.111048 102.364875 102.571921 102.846094 102.882738 103.269671 103.530546 103.719597 104.223368 104.446666 104.596500 104.641065 104.882371 105.021169 105.295812 105.753286 105.999258 106.238771 106.513301 106.766139 106.977415 107.213035 107.946219 108.178995 108.717791 108.809617 108.952080 109.359169 109.706710 109.974893 110.203216 110.333712 110.588628 110.808312 110.992754 111.136477 111.502739 112.032778 112.177955 112.287070 112.387552 112.526440 112.743202 112.969653 113.158252 113.299829 113.525712 113.952183 114.312032 114.509490 114.641107 114.709118 114.827976 115.028054 115.065431 115.162398 115.307637 115.623191 116.244002 116.432633 116.988519 117.517655 118.042477 118.326626 118.418917 118.645322 118.731123 119.390834 119.543990 119.788384 119.998889 120.416456 120.658236 121.153674 121.247622 121.423335 121.659205 122.071159 122.372291 122.810601 122.859329 123.202281 123.570175 123.751967 123.972924 124.273183 124.368444 124.472651 124.610547 124.698334 124.910875 125.023284 125.106897 125.352175 125.444332 125.832032 126.069906 126.084588 126.389205 126.543477 126.921070 126.980549 127.178568 127.407608 127.543886 127.594190 127.723550 128.027529 128.289788 128.424753 128.903427 129.242308 129.358024 129.498959 129.674489 129.931469 130.298653 130.466011 130.810791 130.994296 131.199652 131.454094 131.848162 132.359864 132.445623 132.666022 132.834406 132.961583 133.172504 133.461164 133.703385 133.962949 134.045139 134.511682 134.695197 134.772188 135.085557 135.164644 135.255820 135.366281 135.592805 135.714372 136.061246 136.269802 136.446814 136.747646 137.014935 137.386718 137.611227 138.053071 138.272037 138.810068 139.250900 139.462221 140.569094 141.071675 141.095826 141.390778 141.547683 141.751606 142.266228 142.674377 142.972476 143.042335 143.306695 143.355601 143.599439 143.850546 144.208496 145.490466 145.947407 146.044582 146.283311 146.686763 147.285686 147.503373 147.967426 148.745530 149.023740 149.174637 149.379054 149.850899 150.039629 150.192382 150.366390 151.160725 151.452504 151.855315 152.114209 152.280712 152.998761 153.375750 153.393438 154.180398 154.671984 155.210010 155.861750 156.296101 156.749031 156.817569 157.219362 157.583934 158.132138 158.513636 158.722450 158.854367 160.233151 160.405783 161.457837 161.615039 161.960941 162.421986 162.731099 163.056719 165.782761 165.837523 166.332153 166.553231 167.401340 167.638936 167.674828 168.135465 168.290261 168.596391 169.095307 169.603790 171.254075 171.396115 171.737568 171.836864 172.323640 172.463193 172.855460 173.236427 173.520363 173.678651 174.061617 174.211126 174.847845 174.938060 175.262447 175.373095 175.429271 175.603085 175.860047 175.990436 176.164047 176.335694 176.940259 177.100542 177.224146 177.318247 177.480872 177.973885 178.094647 178.360284 178.421257 178.679326 178.887947 178.916961 179.060002 179.211164 179.301280 179.481024 180.157782 180.295967 180.482991 180.654037 180.884310 181.098791 181.273514 181.382092 181.476092 181.606659 181.837879 182.001648 182.161082 182.414534 182.945605 183.078569 183.126261 183.285766 183.681626 183.781933 184.477832 184.808977 185.161375 189.620629 190.334677 190.951503 191.425243 191.791291 194.649641 195.111264 195.230825 195.679330 200.630838 200.901218 201.278648 202.392305 203.531834 203.791004 204.189902 205.932916 206.667071 207.628829 207.960628 208.879223 209.353841 210.305451 210.530472 211.253027 211.685324 213.038192 213.319469 213.856113 214.350532 214.578125 214.941985 215.926917 216.911049 217.390492 218.290084 218.554923 218.933580 219.524694 220.482898 221.105067 221.622463 222.008696 224.124451 225.057035 227.085094 227.430440 228.573511 228.878258 229.100873 230.477328 231.319959 232.871783 234.560550 235.024193 239.151632 240.456751 245.133171 325.632141 326.616673 331.215378 346.210791 351.686667 352.608106 364.157129 373.578549 377.961957 385.938942 387.505863 394.105673 396.378863 397.635387 400.491531 401.988460 403.185606 404.571870 409.689218 413.049885 416.306880 418.663641 419.935513 423.432984 423.636897 426.708145 429.376803 432.545962 439.245222 440.461138 444.492533 447.048058 918.123918 920.487831 924.669429 A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A -15.26884489 -415.486631 0 GEOMETRY CONVERGED 0.00000000019265 0.00005826924169 0.00020129362264 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 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 C C C H H C H H C H C H H H H H C H H H C C C H H H H H H P C C C H H C H H C H C H H H H H C H H H C C C H H H H H H C H H C H H H Ni C C C O O O 0.2149 0.3500 0.3371 -0.1962 -0.1964 0.1493 -0.1619 -0.1957 0.3442 -0.1441 0.3731 -0.1598 -0.2035 -0.1081 -0.1980 -0.0182 0.5183 -0.1713 -0.2021 -0.2040 -0.2709 0.5834 0.5657 -0.1709 -0.2176 -0.2094 -0.2075 -0.1897 -0.2166 1.1486 0.2178 0.3695 0.3560 -0.1007 -0.1790 0.1481 -0.1674 -0.1954 0.3235 -0.1337 0.3602 -0.1868 -0.1935 -0.1855 -0.1779 -0.1233 0.5202 -0.2064 -0.1978 -0.1762 -0.2551 0.5698 0.5818 -0.2080 -0.1950 -0.1846 -0.2237 -0.1857 -0.2026 0.1164 -0.1706 -0.1615 0.4997 -0.1787 -0.2203 -0.1622 -0.2976 0.3825 0.3804 0.3794 -0.4242 -0.4276 -0.4268 1.2509 1.1248 1.1181 1.1048 1.1082 1.2248 1.0774 1.1106 1.1204 1.0658 1.1223 1.0740 1.1179 1.0020 1.1079 0.9217 0.9900 1.0776 1.1132 1.1149 1.3926 0.9730 0.9784 1.0712 1.1223 1.1139 1.1083 1.0906 1.1213 3.4223 1.2524 1.1292 1.1242 0.9935 1.0890 1.2272 1.0798 1.1094 1.1164 1.0559 1.1211 1.1048 1.1088 1.0942 1.0895 1.0347 0.9889 1.1172 1.1091 1.0824 1.3953 0.9771 0.9752 1.1118 1.0959 1.0870 1.1280 1.0910 1.1035 1.1520 1.0752 1.0665 0.9966 1.0829 1.1294 1.0672 2.3793 1.3799 1.3820 1.3835 1.8686 1.8701 1.8715 2.4555 2.4640 2.4831 0.0850 0.0820 2.5447 0.0784 0.0790 2.4736 0.0724 2.4433 0.0796 0.0795 0.0999 0.0837 0.0901 2.4488 0.0873 0.0827 0.0828 2.7917 2.4000 2.4126 0.0930 0.0889 0.0889 0.0925 0.0923 0.0887 8.1524 2.4504 2.4396 2.4581 0.1004 0.0836 2.5434 0.0813 0.0799 2.4984 0.0719 2.4575 0.0760 0.0787 0.0849 0.0822 0.0822 2.4481 0.0830 0.0825 0.0874 2.7737 2.4097 2.3999 0.0896 0.0925 0.0910 0.0893 0.0882 0.0925 2.6804 0.0889 0.0883 2.4600 0.0894 0.0848 0.0886 7.2548 2.1352 2.1351 2.1343 4.4912 4.4930 4.4907 0.0746 0.0580 0.0585 0.0064 0.0062 0.0769 0.0061 0.0061 0.0586 0.0059 0.0581 0.0061 0.0061 0.0063 0.0063 0.0064 0.0407 0.0064 0.0062 0.0062 0.0822 0.0415 0.0411 0.0067 0.0065 0.0066 0.0067 0.0068 0.0066 0.2321 0.0752 0.0585 0.0585 0.0068 0.0064 0.0770 0.0062 0.0061 0.0585 0.0059 0.0579 0.0060 0.0061 0.0064 0.0062 0.0064 0.0407 0.0062 0.0062 0.0064 0.0816 0.0412 0.0408 0.0066 0.0066 0.0066 0.0064 0.0066 0.0066 0.0488 0.0065 0.0067 0.0414 0.0064 0.0062 0.0064 8.6460 0.0934 0.0934 0.0936 0.0583 0.0584 0.0586 0.0041 0.0032 0.0032 0.0000 0.0000 0.0043 0.0000 0.0000 0.0032 0.0000 0.0032 0.0000 0.0000 0.0000 0.0000 0.0000 0.0022 0.0000 0.0000 0.0000 0.0044 0.0022 0.0022 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0447 0.0041 0.0033 0.0032 0.0000 0.0000 0.0043 0.0000 0.0000 0.0032 0.0000 0.0032 0.0000 0.0000 0.0000 0.0000 0.0000 0.0022 0.0000 0.0000 0.0000 0.0044 0.0022 0.0022 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0024 0.0000 0.0000 0.0022 0.0000 0.0000 0.0000 0.0174 0.0091 0.0091 0.0091 0.0061 0.0061 0.0061