     162
 i =      226, E =     -2413.9629112231
 Zn        14.2384249658       15.5819668917        3.3074907985
  O        28.0183415994        6.6384451298        2.5019733919
  O        27.6742303363        5.1602423606        4.1675138459
  O         0.8721060837       21.2699777313        4.6976992792
  C        27.5405041762        5.5323128805        2.9530196785
  C        26.8013681545        4.6625981258        1.9978163383
  C         0.4673024485       20.0971792722        5.2675648965
  C        -0.2164763406       19.1808556385        4.4617226266
  H        -0.3893195330       19.4357568135        3.4188063196
 Zn         2.2496363995       21.5299867076        3.2492787146
  O        16.1439114080       15.2961282999        2.5541049407
  O        17.6093371829       15.7137366525        4.2131793871
  O         3.9993283476        7.0921312379        4.6984277496
  C        17.3448217734       15.4192571718        2.9987549919
  C        18.4635999022       15.2080308738        2.0361660845
  C         5.2166229648        7.3276514442        5.2694459357
  C         6.3527859185        7.1904195787        4.4648761391
  H         6.2196214010        6.9114077786        3.4221900108
 Zn         3.0834364364        8.1549306233        3.2487087117
  O        14.5797034991        0.6929765249        2.5008874750
  O        13.4803800384        1.7334302520        4.1702056124
  O        14.7525654380       16.8999490724        4.7401144880
  C        13.8664515299        1.6626582542        2.9549395461
  C        13.4861740058        2.7401755736        2.0014314271
  C        13.9275271101       17.8295204299        5.3011306426
  C        13.4729830395       18.8723086147        4.4860414283
  H        13.7889554710       18.8913740401        3.4455716539
 Zn        11.8677912834        7.0802521495        3.7031743833
  O        -1.8573282510       15.9495994893        4.4140994681
  O        -1.5690881511       17.4633397368        2.7741674174
  O        25.2311154444        1.3496240511        2.2460579101
  C        -1.4125610619       17.0762399418        3.9816056408
  C        -0.6836576577       17.9484014836        4.9426495419
  C        25.6395837174        2.5193343300        1.6730313729
  C        26.3274803976        3.4331868567        2.4790046418
  H        26.5005782227        3.1765449562        3.5215282724
 Zn        23.8444559231        1.0966479490        3.6963836664
  O         9.9723576742        7.3210639481        4.4523866909
  O         8.5224348736        6.9052181584        2.7775354098
  O        22.1184498331       15.5202922828        2.2549637745
  C         8.7768247222        7.1942603054        3.9952264565
  C         7.6530239883        7.3981344445        4.9487430830
  C        20.8980140110       15.2839178482        1.6911363136
  C        19.7682880160       15.4174708575        2.5062905279
  H        19.9114936559       15.6972312636        3.5472435830
 Zn        23.0224512151       14.4516581384        3.7024514267
  O        11.4762796735       21.8973379246        4.4130635675
  O        12.6447180828       20.8868841489        2.7773296349
  O        11.4090543775        5.7612004665        2.2528629109
  C        12.2333117039       20.9491818878        3.9855634978
  C        12.6278593123       19.8895074218        4.9542961263
  C        12.2186788319        4.8221589188        1.6823275915
  C        12.6621337665        3.7666953124        2.4860761581
  H        12.3536942370        3.7432809606        3.5286663435
 Zn        14.2399391043        0.4844729711        5.5672115578
  O        14.9735938031       14.1817752852        4.8644331709
  O        14.5668091863       12.7299348102        6.5386096996
  O        26.9931359093        6.1880142622        0.0631094664
  C        14.4636529506       13.0940503603        5.3188662395
  C        13.7233617192       12.2274324557        4.3566563648
  C        26.5837436555        5.0171103853        0.6326370584
  C        25.8958195207        4.1043554921        6.7771391443
  H        25.7246565268        4.3609221955        5.7342898187
 Zn        28.3690871918        6.4461385032        5.5649437819
  O        16.1360867025        0.2262053244        4.8198297381
  O        17.5894909799        0.6656985170        6.4847099096
  O        17.0410012859       14.6031476909        0.1095717182
  C        17.3332552101        0.3635510132        5.2705934856
  C        18.4554014288        0.1564531032        4.3152790787
  C        18.2611082315       14.8382940126        0.6728582484
  C        19.3906328204       14.7027389493        6.8082740382
  H        19.2470035369       14.4247817521        5.7667181017
 Zn        16.1451995746       15.6922350455        5.6155649180
  O        27.6425398291        8.2185033128        4.8172234716
  O        26.5399831341        9.2578387800        6.4850551484
  O        14.7081587169        1.8112359247        0.0637162095
  C        26.9252176417        9.1863663313        5.2696387926
  C        26.5385019617       10.2602646038        4.3147521695
  C        13.9021119094        2.7527187005        0.6357950807
  C        13.4604370539        3.8099714430        6.7836222333
  H        13.7694086728        3.8334121876        5.7411408088
 Zn        -1.1868646111       14.6008928245        6.0138143878
  O        24.2329147856        0.8856353325        6.7316034220
  O        24.5393581472        2.3908014545        5.0868501205
  O        12.1624581539        8.9085441486        4.5750644821
  C        24.6885749436        2.0061715875        6.2963449146
  C        25.4224403006        2.8742225162        0.3066068063
  C        12.5674665261       10.0841838093        4.0142927343
  C        13.2452931796       10.9968335677        4.8302225528
  H        13.4105704425       10.7363105702        5.8729551185
 Zn        10.7965807241        8.6463716877        6.0229974012
  O        23.0109051310       14.9119516748        6.7331269527
  O        21.5513016770       14.4006835284        5.0998649651
  O        22.1090005894        0.4566936216        4.5635858991
  C        21.8105452107       14.7285399234        6.3073437064
  C        20.6951833606       14.9180532848        0.3258016190
  C        20.8921020679        0.2244199020        3.9913982124
  C        19.7566501192        0.3602064244        4.7975605531
  H        19.8918508746        0.6366648713        5.8406381661
 Zn         9.9685425752       21.9926584211        6.0133527468
  O        11.5381833859        6.8827802771        6.7693491004
  O        12.6413381743        5.8441802532        5.1010766243
  O        24.4436829722       13.2694452399        4.5648094061
  C        12.2536900227        5.9142183420        6.3160042563
  C        12.6357814708        4.8363421568        0.3174919886
  C        25.2557579697       12.3338090490        3.9910915749
  C        25.7079407730       11.2829097469        4.7967699917
  H        25.4009124929       11.2608541263        5.8397856614
 Zn        27.3015396448        8.0112313169        0.9318868149
  O         1.9039701887       21.7196206491        0.1833935978
  O         1.5495748817       20.2479132583        1.8525745710
  O        13.9219376812       13.7567574378        2.4279433000
  C         1.4215875942       20.6160213148        0.6365900617
  C         0.6854741893       19.7438316025        6.6328708560
  C        13.5155786795       12.5820859010        2.9896733165
  C        12.8294254708       11.6728690040        2.1758485603
  H        12.6622518187       11.9335752516        1.1333612075
 Zn        15.3005623947       14.0062756238        0.9853394589
  O         3.0941958614        7.7535829606        0.1871021096
  O         4.5448357122        8.2022614759        1.8524009630
  O         3.9862702230       22.1683182371        2.3797618175
  C         4.2902040452        7.8978845687        0.6383880058
  C         5.4133674153        7.6954532446        6.6346288006
  C         5.2049696765       22.3985885142        2.9496992837
  C         6.3398353097       22.2599153954        2.1438626365
  H         6.2050085662       21.9827207437        1.1010041214
 Zn        16.1288345162        0.6254919620        0.9311009284
  O        14.6195343187       15.7905756771        0.2338895709
  O        13.4646910263       16.8031549355        1.8791379525
  O         1.6616248950        9.3354325457        2.3789477534
  C        13.8779010234       16.7459643302        0.6722726437
  C        13.4975240374       17.8164577720        6.6620972945
  C         0.8492166901       10.2724802044        2.9493866633
  C         0.3990690179       11.3235873256        2.1438000462
  H         0.7066313102       11.3457034703        1.1010622852
 Zn        11.8658771596       22.1349235611        1.3823616654
  O        11.1560531830        8.4573609296        2.1337690112
  O        11.4849525997        9.9437979343        0.4739717761
  O        -0.8713491652       16.4244214712        6.8820804806
  C        11.6233474939        9.5700651825        1.6871585853
  C        12.3551035352       10.4412578976        2.6487618896
  C        -0.4667711321       17.5951863386        6.3095444327
  C         0.2159717974       18.5131312556        0.1644060802
  H         0.3890253812       18.2586415265        1.2073707030
 Zn        -2.2572618566       16.1672961308        1.3810065462
  O         9.9584729837       22.4457907325        2.0961083817
  O         8.5026105842       21.9412721620        0.4559949812
  O         9.0668071625        8.0034269394        6.8854816196
  C         8.7602702290       22.2698966618        1.6634369508
  C         7.6413504878       22.4673112408        2.6247185725
  C         7.8493185351        7.7665837342        6.3135213657
  C         6.7135650310        7.9046309378        0.1670056670
  H         6.8464811609        8.1853895089        1.2091024844
 Zn         9.9865571189        6.9451965968        1.3851310251
  O        -1.5592387019       14.3710768861        2.1015668167
  O        -0.4180831566       13.3495252966        0.4527381896
  O        11.3871569030       20.8147254565        6.8851002235
  C        -0.8207918796       13.4145465101        1.6637438003
  C        -0.4330971406       12.3455299923        2.6245488451
  C        12.2052720881       19.8799273415        6.3184970874
  C        12.6558235992       18.8347740245        0.1810860115
  H        12.3402690382       18.8152968807        1.2215247173
