      59
 i =        0, time =        0.000, E =     -4213.9728370725
 Ga         0.5374300000        2.9594700000       -0.0188600000
 Ga         0.6583700000        2.7862300000        2.6595800000
 Ga         0.4063800000        2.9271700000        5.3718800000
 Ga         0.3872900000        2.9116400000        8.3258400000
 Ga         0.2627500000        5.6399200000       -0.1583100000
 Ga         0.5124600000        5.5855400000        2.7000300000
 Ga         0.5464800000        5.6628800000        5.5197700000
 Ga         0.5157600000        5.8502300000        8.3145300000
 Ga         0.5343400000        8.4736900000       -0.0842000000
 Ga         0.5778200000        8.5515400000        2.7115500000
 Ga         0.5235700000        8.5001500000        5.4786200000
 Ga         0.4801500000        8.6783700000        8.0951600000
 Ga         0.6225000000       11.3108300000       -0.1189800000
 Ga         0.6865600000       11.2995300000        2.6029000000
 Ga         0.5100900000       11.3367600000        5.3731300000
 Ga         0.5271200000       11.4318200000        8.2406200000
 Ga         3.2707700000        2.8186500000       -0.1691400000
 Ga         3.3894900000        2.9427200000        2.7956700000
 Ga         3.1804400000        2.9023800000        5.6331400000
 Ga         3.0456400000        2.8338700000        8.3026600000
 Ga         3.1921400000        5.7635200000        0.0480900000
 Ga         8.8315700000        8.5566200000        2.6657300000
 Ga         9.0508500000        8.5408800000       -0.0951800000
 Ga         3.2648400000        5.6073900000        8.4054600000
 Ga         3.2608100000        8.4936200000       -0.1392500000
 Ga         8.9319900000        8.3884300000        8.3155100000
 Ga         8.7967000000        8.4485200000        5.3510600000
 Ga         3.2366800000        8.4870200000        8.2569000000
 Ga         3.4089500000       11.2760500000       -0.2108600000
 Ga         3.3491100000       11.2872000000        2.6269300000
 Ga         3.2833000000       11.1900400000        5.3653500000
 Ga         3.3591400000       11.2902900000        8.1559300000
 Ga         6.0688300000        3.1380700000       -0.0099300000
 Ga         6.1635300000        2.7540700000        2.8213900000
 Ga         6.0532000000        2.6506900000        5.5973600000
 Ga         5.9657200000        2.9300300000        8.2663100000
 Ga         6.0268500000        5.7285600000        0.0106000000
 Ga         8.8754500000       11.1425600000        5.4553800000
 Ga         8.9962000000       11.1850300000        2.7205000000
 Ga         6.1706900000        5.7162200000        8.3018600000
 Ga         6.1909600000        8.4582500000       -0.0330100000
 Ga         8.8394200000       11.3935700000        8.1792500000
 Ga         8.7980400000       11.2570300000       -0.1573000000
 Ga         6.2159000000        8.3640200000        8.2566800000
 Ga         6.0468800000       11.5315300000       -0.1548300000
 Ga         6.1260900000       11.1211400000        2.6786200000
 Ga         5.9171500000       11.0854400000        5.3854000000
 Ga         6.1372400000       11.0611700000        8.1490200000
 Ga         8.9744100000        2.9711700000       -0.0897800000
 Ga         8.8900100000        2.7266700000        2.6484700000
 Ga         8.7464700000        2.9417300000        5.7008900000
 Ga         8.6132100000        2.8791000000        8.3067400000
 Ga         8.8266500000        5.7597800000       -0.1624100000
 Ga         8.8726600000        5.7844700000        2.7223800000
 Ga         9.0766700000        5.6657000000        5.4684100000
 Ga         9.0976100000        5.6714800000        8.2874100000
  C         4.5977200000        7.1909600000        3.8951900000
  O         3.4983500000        7.4399900000        3.5979900000
  O         5.7065000000        6.9046100000        4.1730500000
      59
 i =        1, time =        0.500, E =     -4213.9759764220
 Ga         0.5362506184        2.9578113938       -0.0182768606
 Ga         0.6576652955        2.7844506977        2.6580229751
 Ga         0.4055352780        2.9248267932        5.3714257701
 Ga         0.3856792929        2.9109812496        8.3239006322
 Ga         0.2619002778        5.6375915860       -0.1575773888
 Ga         0.5115363132        5.5843069374        2.6988506830
 Ga         0.5455539803        5.6611074553        5.5158087020
 Ga         0.5143846426        5.8467874221        8.3096488137
 Ga         0.5350284131        8.4688676030       -0.0843189108
 Ga         0.5795402133        8.5469542772        2.7099405880
 Ga         0.5249523308        8.4955691210        5.4768680011
 Ga         0.4796071639        8.6755920344        8.0915228910
 Ga         0.6225799050       11.3044548906       -0.1195834348
 Ga         0.6860126738       11.2952332079        2.6016280612
 Ga         0.5116156416       11.3315911651        5.3726313854
 Ga         0.5274673425       11.4268624925        8.2368127497
 Ga         3.2678494868        2.8184292208       -0.1693407416
 Ga         3.3883545709        2.9417138059        2.7950006039
 Ga         3.1790180369        2.9008203319        5.6299454475
 Ga         3.0451442527        2.8330217429        8.2994880738
 Ga         3.1905689833        5.7628879460        0.0469986978
 Ga         8.8275488662        8.5522487352        2.6659939638
 Ga         9.0467421807        8.5363797582       -0.0978315073
 Ga         3.2631050199        5.6049532909        8.4006118302
 Ga         3.2601166668        8.4890785207       -0.1376925790
 Ga         8.9288988573        8.3858457189        8.3122624945
 Ga         8.7911823070        8.4450906539        5.3489977428
 Ga         3.2352670797        8.4831268643        8.2515208580
 Ga         3.4071682959       11.2714587169       -0.2119811366
 Ga         3.3476279115       11.2816265385        2.6256804720
 Ga         3.2830559388       11.1857983460        5.3622569419
 Ga         3.3581921294       11.2860889283        8.1542537818
 Ga         6.0671639124        3.1377708913       -0.0095521445
 Ga         6.1597803599        2.7520544759        2.8219985548
 Ga         6.0511172683        2.6487761881        5.5936042266
 Ga         5.9619004927        2.9288087536        8.2608806237
 Ga         6.0248988622        5.7254600243        0.0101695826
 Ga         8.8731406866       11.1379494409        5.4529407830
 Ga         8.9917867317       11.1798399628        2.7178335522
 Ga         6.1678061243        5.7136978476        8.2982832173
 Ga         6.1882458155        8.4527679256       -0.0334610119
 Ga         8.8343247674       11.3877689674        8.1750072575
 Ga         8.7935537993       11.2514428956       -0.1569288424
 Ga         6.2124220649        8.3600573953        8.2513135639
 Ga         6.0424796765       11.5261341183       -0.1549884936
 Ga         6.1227684121       11.1150461285        2.6780312433
 Ga         5.9146912286       11.0783084796        5.3834383200
 Ga         6.1358609580       11.0560629782        8.1438177222
 Ga         8.9700452312        2.9693875937       -0.0890798046
 Ga         8.8854506178        2.7256941499        2.6478685074
 Ga         8.7424096853        2.9402858188        5.6994213581
 Ga         8.6082671652        2.8788606210        8.3035098604
 Ga         8.8246695572        5.7580929619       -0.1622350324
 Ga         8.8687036780        5.7819931233        2.7196421656
 Ga         9.0722334690        5.6613908278        5.4651218120
 Ga         9.0925101135        5.6686282554        8.2848745239
  C         4.5952922425        7.1863562304        3.8977686647
  O         3.4948985547        7.4395330392        3.5966051067
  O         5.7044276576        6.9040782520        4.1720424015
      59
 i =        2, time =        1.000, E =     -4213.9899530052
 Ga         0.5338539232        2.9495443524       -0.0176632834
 Ga         0.6554810827        2.7764518812        2.6505533344
 Ga         0.4037706137        2.9159480444        5.3590218301
 Ga         0.3831731203        2.9038372788        8.3034373413
 Ga         0.2604554858        5.6227199620       -0.1564941183
 Ga         0.5094643376        5.5706539838        2.6916664660
 Ga         0.5434025797        5.6467393031        5.4995371089
 Ga         0.5118378015        5.8303189341        8.2862552913
 Ga         0.5345163135        8.4451619871       -0.0842621913
 Ga         0.5799779727        8.5233076757        2.7022973649
 Ga         0.5251735621        8.4720466872        5.4629045366
 Ga         0.4779805722        8.6534900687        8.0698824346
 Ga         0.6212672402       11.2728937189       -0.1199395560
 Ga         0.6839176630       11.2657931756        2.5945692370
 Ga         0.5120086045       11.3011862972        5.3601787026
 Ga         0.5266348714       11.3964641412        8.2146639096
 Ga         3.2576482161        2.8119358583       -0.1691716260
 Ga         3.3796851277        2.9341513998        2.7881156147
 Ga         3.1705273829        2.8927937126        5.6141872069
 Ga         3.0378979098        2.8258593004        8.2778461019
 Ga         3.1818933646        5.7494314114        0.0457936267
 Ga         8.8038596812        8.5288052947        2.6603286725
 Ga         9.0224909522        8.5128468264       -0.1002987690
 Ga         3.2541135045        5.5900394886        8.3770460267
 Ga         3.2521847015        8.4656174062       -0.1358245061
 Ga         8.9059415903        8.3645975290        8.2905054885
 Ga         8.7660681964        8.4228400868        5.3350304858
 Ga         3.2266599444        8.4603249072        8.2277526804
 Ga         3.3977952180       11.2417695168       -0.2126478753
 Ga         3.3387088725       11.2509257018        2.6185869084
 Ga         3.2755101371       11.1566530038        5.3472055124
 Ga         3.3497729031       11.2567637938        8.1344378575
 Ga         6.0519893811        3.1304654726       -0.0091574424
 Ga         6.1422871083        2.7438950093        2.8163432308
 Ga         6.0355405331        2.6409408116        5.5773570331
 Ga         5.9447646689        2.9210566052        8.2370501384
 Ga         6.0095221953        5.7096208456        0.0097071427
 Ga         8.8510821763       11.1085438627        5.4383480579
 Ga         8.9673444947       11.1497666813        2.7091031047
 Ga         6.1511747613        5.6984446634        8.2762309045
 Ga         6.1717386684        8.4284458649       -0.0338415665
 Ga         8.8095561553       11.3565986622        8.1525634996
 Ga         8.7694870106       11.2208006527       -0.1562104126
 Ga         6.1950825373        8.3374686897        8.2275551186
 Ga         6.0246044912       11.4950614337       -0.1548086886
 Ga         6.1057981847       11.0841857836        2.6714845417
 Ga         5.8990664813       11.0464831954        5.3694813741
 Ga         6.1208124879       11.0263384164        8.1204689265
 Ga         8.9456997294        2.9609765649       -0.0881923624
 Ga         8.8611030803        2.7186483484        2.6413941448
 Ga         8.7188887253        2.9322836301        5.6852349427
 Ga         8.5841574449        2.8722100710        8.2818116480
 Ga         8.8030596703        5.7435948880       -0.1617037733
 Ga         8.8449962503        5.7666333871        2.7108338685
 Ga         9.0475992295        5.6444631419        5.4496451133
 Ga         9.0671529064        5.6531460630        8.2639007847
  C         4.5828097338        7.1657192709        3.8917688232
  O         3.4818974579        7.4229468626        3.5867344811
  O         5.6912595832        6.8877879364        4.1621602265
      59
 i =        3, time =        1.500, E =     -4214.0149065587
 Ga         0.5302441196        2.9345994730       -0.0170297357
 Ga         0.6518086800        2.7621722824        2.6371105330
 Ga         0.4010879357        2.9004787380        5.3344941050
 Ga         0.3797888977        2.8901216138        8.2642040818
 Ga         0.2584223667        5.5951578224       -0.1550689387
 Ga         0.5062433950        5.5444148853        2.6784079968
 Ga         0.5400244083        5.6196167155        5.4708429395
 Ga         0.5081280282        5.8006912071        8.2441595436
 Ga         0.5327725352        8.4023765876       -0.0840246322
 Ga         0.5790798922        8.4803965026        2.6885587659
 Ga         0.5241887579        8.4293806044        5.4365765303
 Ga         0.4752644282        8.6118217759        8.0300327848
 Ga         0.6185393460       11.2158830402       -0.1200327474
 Ga         0.6802619494       11.2109074281        2.5816595751
 Ga         0.5112222943       11.2452583774        5.3355986449
 Ga         0.5245981272       11.3403306085        8.1739660237
 Ga         3.2401108078        2.7990781630       -0.1686232493
 Ga         3.3633882190        2.9199515610        2.7749326713
 Ga         3.1548872009        2.8782309290        5.5857343794
 Ga         3.0238068020        2.8123021192        8.2375121859
 Ga         3.1660347209        5.7229665986        0.0444933809
 Ga         8.7602793925        8.4860817028        2.6486382834
 Ga         8.9778668970        8.4700763800       -0.1025280333
 Ga         3.2377876208        5.5625045439        8.3345692526
 Ga         3.2369167482        8.4230339824       -0.1336718022
 Ga         8.8628734200        8.3244493023        8.2500180556
 Ga         8.7211640177        8.3815457877        5.3090159248
 Ga         3.2107755615        8.4183994362        8.1854179481
 Ga         3.3807485850       11.1866861063       -0.2128318807
 Ga         3.3222673915       11.1948212242        2.6055837967
 Ga         3.2605557477       11.1023052709        5.3200721829
 Ga         3.3337863968       11.2020105309        8.0962372006
 Ga         6.0231317312        3.1160527587       -0.0087525729
 Ga         6.1109117528        2.7295355053        2.8043167552
 Ga         6.0063032917        2.6271291993        5.5484992611
 Ga         5.9141819918        2.9066971908        8.1946406446
 Ga         5.9805520764        5.6809070567        0.0092198026
 Ga         8.8090167426       11.0540524702        5.4114624597
 Ga         8.9226515269       11.0945287113        2.6942668943
 Ga         6.1206407675        5.6703142678        8.2354893576
 Ga         6.1412794945        8.3851003430       -0.0341424422
 Ga         8.7649105630       11.2997823494        8.1117213658
 Ga         8.7256256548       11.1648268780       -0.1551464539
 Ga         6.1637361065        8.2960446603        8.1852263613
 Ga         5.9931325025       11.4380226434       -0.1542824692
 Ga         6.0750342208       11.0282972273        2.6588999744
 Ga         5.8701215064       10.9897237573        5.3433835155
 Ga         6.0919120122       10.9717171504        8.0787955740
 Ga         8.9011516149        2.9458698093       -0.0871280907
 Ga         8.8167522609        2.7054584207        2.6289685699
 Ga         8.6756869826        2.9176512147        5.6581647591
 Ga         8.5406819295        2.8590551494        8.2414246469
 Ga         8.7615578923        5.7161220583       -0.1608142744
 Ga         8.8013117339        5.7382411967        2.6959147162
 Ga         9.0025438888        5.6148066137        5.4218563865
 Ga         9.0213265147        5.6248951888        8.2242552186
  C         4.5600214540        7.1289179491        3.8769794744
  O         3.4593804022        7.3899697740        3.5683035177
  O         5.6668604779        6.8555126197        4.1432823885
      59
 i =        4, time =        2.000, E =     -4214.0491825326
 Ga         0.5254721174        2.9132504806       -0.0163794184
 Ga         0.6467098037        2.7418695683        2.6179416809
 Ga         0.3975251216        2.8786909229        5.2983366573
 Ga         0.3755640842        2.8701024136        8.2069688576
 Ga         0.2558254539        5.5554275096       -0.1533182100
 Ga         0.5019205532        5.5061052855        2.6593253526
 Ga         0.5354694926        5.5802629503        5.4302390994
 Ga         0.5033043039        5.7584470418        8.1841330492
 Ga         0.5298446165        8.3412968641       -0.0836139555
 Ga         0.5768954032        8.4190129305        2.6689760892
 Ga         0.5220427915        8.3683581283        5.3983893415
 Ga         0.4715036695        8.5513882309        7.9727242787
 Ga         0.6144524333       11.1344722075       -0.1198735419
 Ga         0.6751087091       11.1316208930        2.5631407681
 Ga         0.5093004139       11.1648572370        5.2993853360
 Ga         0.5214047406       11.2595199942        8.1154825635
 Ga         3.2155428506        2.7801149152       -0.1677111675
 Ga         3.3397774092        2.8993851808        2.7557094788
 Ga         3.1323925036        2.8574002265        5.5451087756
 Ga         3.0031521181        2.7926107960        8.1792544463
 Ga         3.1432892979        5.6840241037        0.0431026764
 Ga         8.6976265910        8.4248699034        2.6311668993
 Ga         8.9137083453        8.4088595594       -0.1045242588
 Ga         3.2144303959        5.5228677974        8.2739614081
 Ga         3.2146142696        8.3621151251       -0.1312503059
 Ga         8.8005204050        8.2661755703        8.1915691530
 Ga         8.6572879142        8.3219878066        5.2714494324
 Ga         3.1879139425        8.3581355694        8.1252849808
 Ga         3.3563439024       11.1072511951       -0.2125512010
 Ga         3.2986139369       11.1143599495        2.5869140585
 Ga         3.2384947396       11.0237906210        5.2813546995
 Ga         3.3105429654       11.1228726808        8.0404044750
 Ga         5.9811510152        3.0948207512       -0.0083391942
 Ga         6.0662257573        2.7092308659        2.7861775908
 Ga         5.9639640101        2.6075871695        5.5075502523
 Ga         5.8707054104        2.8860015393        8.1344204680
 Ga         5.9385445570        5.6398506859        0.0087089195
 Ga         8.7477633605       10.9755071108        5.3727883548
 Ga         8.8585413793       11.0151623052        2.6735788384
 Ga         6.0767752301        5.6298354258        8.1768271047
 Ga         6.0974404223        8.3235166684       -0.0343671307
 Ga         8.7012083163       11.2183760382        8.0532391543
 Ga         8.6627847181       11.0845646338       -0.1537523930
 Ga         6.1189584781        8.2365594707        8.1250948376
 Ga         5.9486258878       11.3560856295       -0.1534243363
 Ga         6.0310441813       10.9484124191        2.6405243494
 Ga         5.8284039704       10.9090614360        5.3056424476
 Ga         6.0497249369       10.8932233003        8.0195547262
 Ga         8.8372326416        2.9243424589       -0.0858969325
 Ga         8.7532229940        2.6863760332        2.6108367998
 Ga         8.6136146667        2.8966611609        5.6187357502
 Ga         8.4786401563        2.8396603335        8.1831182634
 Ga         8.7009782006        5.6762061461       -0.1595824371
 Ga         8.7384719287        5.6973514565        2.6751391703
 Ga         8.9379085238        5.5729489035        5.3822628358
 Ga         8.9558751246        5.5844012618        8.1667033112
  C         4.5272111463        7.0766464397        3.8537255568
  O         3.4277333657        7.3412741887        3.5416593641
  O         5.6318058113        6.8078788736        4.1158016730
      59
 i =        5, time =        2.500, E =     -4214.0886392525
 Ga         0.5196069387        2.8859127506       -0.0157133003
 Ga         0.6402741926        2.7159328334        2.5934213421
 Ga         0.3931342139        2.8509910368        5.2513209949
 Ga         0.3705431127        2.8441944497        8.1329204506
 Ga         0.2526961886        5.5043289763       -0.1512617755
 Ga         0.4965628647        5.4565236342        2.6348009152
 Ga         0.5298087824        5.5294841343        5.3784966467
 Ga         0.4974311405        5.7044089996        8.1073456251
 Ga         0.5258119933        8.2631146265       -0.0830441645
 Ga         0.5735182941        8.3403612007        2.6439299053
 Ga         0.5188190030        8.2901759829        5.3491207321
 Ga         0.4667631125        8.4734227822        7.8991043498
 Ga         0.6090944688       11.0302546007       -0.1194845810
 Ga         0.6685516254       11.0295374503        2.5393809859
 Ga         0.5063240727       11.0615867438        5.2523099113
 Ga         0.5171317359       11.1556512545        8.0403793292
 Ga         3.1843991363        2.7554500765       -0.1664616126
 Ga         3.3093349679        2.8728690576        2.7308447020
 Ga         3.1034940974        2.8307093101        5.4931019476
 Ga         2.9763713579        2.7671868392        8.1042519395
 Ga         3.1141082263        5.6334303076        0.0416203786
 Ga         8.6171504882        8.3463754075        2.6082993787
 Ga         8.8312963427        8.3303995480       -0.1063182745
 Ga         3.1845026112        5.4719232695        8.1964048757
 Ga         3.1857444422        8.2840579979       -0.1285698777
 Ga         8.7201532242        8.1909701020        8.1163381686
 Ga         8.5756763268        8.2453612162        5.2230909660
 Ga         3.1585340457        8.2807323294        8.0485126264
 Ga         3.3250610325       11.0050627000       -0.2118439418
 Ga         3.2682232306       11.0111350173        2.5629478178
 Ga         3.2097982519       10.9226963008        5.2318080442
 Ga         3.2805212959       11.0209527928        7.9681064473
 Ga         5.9269118329        3.0672174499       -0.0079173953
 Ga         6.0090942821        2.6833650547        2.7623357670
 Ga         5.9093812654        2.5826856410        5.4552931810
 Ga         5.8151699645        2.8593841397        8.0575503497
 Ga         5.8843556522        5.5872602934        0.0081742537
 Ga         8.6685877126       10.8744881750        5.3230966914
 Ga         8.7762848387       10.9132503246        2.6474146374
 Ga         6.0204501171        5.5778156734        8.1014187757
 Ga         6.0410962219        8.2448813891       -0.0345244275
 Ga         8.6196943192       11.1139874883        7.9782715355
 Ga         8.5822056672       10.9816037640       -0.1520497786
 Ga         6.0616233069        8.1601947385        8.0483189951
 Ga         5.8919300073       11.2508804142       -0.1522586803
 Ga         5.9746907415       10.8460984591        2.6167397132
 Ga         5.7747527525       10.8060528756        5.2570222221
 Ga         5.9951265136       10.7924216030        7.9438908864
 Ga         8.7552110904        2.8968104994       -0.0845091047
 Ga         8.6717710460        2.6617874815        2.5873784186
 Ga         8.5339095224        2.8697276412        5.5677581578
 Ga         8.3992458700        2.8144376748        8.1080734268
 Ga         8.6225816122        5.6246668918       -0.1580319807
 Ga         8.6577322107        5.6447820251        2.6488830445
 Ga         8.8549740407        5.5196811708        5.3316327004
 Ga         8.8720799666        5.5324642970        8.0924253429
  C         4.4848901849        7.0099390409        3.8225580978
  O         3.3874419461        7.2779308285        3.5073111883
  O         5.5870065697        6.7458573755        4.0803341894
      59
 i =        6, time =        3.000, E =     -4214.1276311462
 Ga         0.5128757655        2.8538295352       -0.0150431337
 Ga         0.6327781210        2.6855322262        2.5646680443
 Ga         0.3880863151        2.8186103200        5.1956968458
 Ga         0.3648919960        2.8136170871        8.0455500921
 Ga         0.2491459826        5.4442310130       -0.1489699569
 Ga         0.4903868374        5.3980120792        2.6059687143
 Ga         0.5232731758        5.4696562107        5.3179391958
 Ga         0.4907272733        5.6410374390        8.0172947143
 Ga         0.5208937805        8.1713928525       -0.0823518864
 Ga         0.5691852377        8.2480353793        2.6145601804
 Ga         0.5147312341        8.1984071036        5.2910685590
 Ga         0.4612440635        8.3815660020        7.8125759606
 Ga         0.6027229350       10.9079871106       -0.1189155726
 Ga         0.6608781683       10.9094015079        2.5114744095
 Ga         0.5024989861       10.9402103533        5.1966224003
 Ga         0.5119969412       11.0335265702        7.9521194567
 Ga         3.1480592324        2.7262625827       -0.1649454920
 Ga         3.2734832029        2.8416378445        2.7015098823
 Ga         3.0695283201        2.7993767011        5.4320816835
 Ga         2.9447413643        2.7372171941        8.0159915190
 Ga         3.0798329044        5.5735978040        0.0400696220
 Ga         8.5225613235        8.2541929038        2.5811487596
 Ga         8.7344342021        8.2382856905       -0.1079418805
 Ga         3.1493767795        5.4120265111        8.1054342647
 Ga         3.1516748857        8.1924339881       -0.1256932298
 Ga         8.6255223331        8.1023525896        8.0278166994
 Ga         8.4800303109        8.1552117503        5.1661884206
 Ga         3.1239961157        8.1897546116        7.9585759988
 Ga         3.2883316083       10.8848559546       -0.2107958425
 Ga         3.2325026322       10.8898883900        2.5347875487
 Ga         3.1758395723       10.8037182013        5.1736893048
 Ga         3.2451303824       10.9009907936        7.8827630817
 Ga         5.8629595209        3.0345539498       -0.0074936503
 Ga         5.9421094528        2.6530974148        2.7339689199
 Ga         5.8450943854        2.5535410254        5.3940833823
 Ga         5.7500843751        2.8280744260        7.9675112469
 Ga         5.8205135204        5.5255452228        0.0076225549
 Ga         8.5752124109       10.7556769919        5.2646785813
 Ga         8.6796630371       10.7934934087        2.6169217868
 Ga         5.9542576637        5.5166547307        8.0127493535
 Ga         5.9748463764        8.1527542107       -0.0346269187
 Ga         8.5240873966       10.9914056321        7.8902573560
 Ga         8.4875864203       10.8606760321       -0.1501068453
 Ga         5.9943431029        8.0704648445        7.9583740508
 Ga         5.8255914574       11.1272519738       -0.1508508731
 Ga         5.9085492822       10.7260311537        2.5886679904
 Ga         5.7116535179       10.6853622903        5.1997833238
 Ga         5.9306887448       10.6739599229        7.8552345233
 Ga         8.6588591324        2.8645221832       -0.0830064669
 Ga         8.5761342569        2.6328362995        2.5597045875
 Ga         8.4402478630        2.8380847759        5.5076204342
 Ga         8.3061234139        2.7845908577        8.0197803105
 Ga         8.5300696849        5.5639196166       -0.1562329049
 Ga         8.5628195761        5.5829606604        2.6182951779
 Ga         8.7575534780        5.4573895111        5.2722661546
 Ga         8.7737671201        5.4714668547        8.0048992260
  C         4.4348693819        6.9318419907        3.7850756217
  O         3.3400264672        7.2030453488        3.4667793319
  O         5.5349058859        6.6723310214        4.0386370325
      59
 i =        7, time =        3.500, E =     -4214.1597159000
 Ga         0.5055998777        2.8188918935       -0.0143736380
 Ga         0.6246325294        2.6524433206        2.5333857460
 Ga         0.3826246567        2.7834044370        5.1349589726
 Ga         0.3588236406        2.7802534500        7.9502493276
 Ga         0.2453254356        5.3787658329       -0.1465335873
 Ga         0.4837060983        5.3341895962        2.5745657354
 Ga         0.5161977101        5.4044371121        5.2520818019
 Ga         0.4834954583        5.5720761471        7.9193034897
 Ga         0.5154482955        8.0715553878       -0.0815981406
 Ga         0.5643089696        8.1475139098        2.5826017923
 Ga         0.5101497075        8.0984972959        5.2277656654
 Ga         0.4552440023        8.2814184389        7.7183489833
 Ga         0.5957415333       10.7749157415       -0.1182614916
 Ga         0.6525189311       10.7784964998        2.4810934670
 Ga         0.4981865450       10.8080163053        5.1358167566
 Ga         0.5063485503       10.9005017239        7.8560003047
 Ga         3.1085971694        2.6943843585       -0.1632794570
 Ga         3.2344108370        2.8075885827        2.6695145978
 Ga         3.0325420008        2.7652618646        5.3656515727
 Ga         2.9102427588        2.7045287802        7.9198263667
 Ga         3.0425126115        5.5082707252        0.0384580629
 Ga         8.4195340674        8.1538078457        2.5514575706
 Ga         8.6289422978        8.1379921698       -0.1095168659
 Ga         3.1111484070        5.3467850089        8.0064303823
 Ga         3.1145215957        8.0926879191       -0.1226787332
 Ga         8.5223935824        8.0057418391        7.9313618993
 Ga         8.3759719483        8.0569743101        5.1041915163
 Ga         3.0863842614        8.0906538429        7.8607480453
 Ga         3.2483404150       10.7538912265       -0.2095712432
 Ga         3.1936087368       10.7578651652        2.5041195392
 Ga         3.1387538828       10.6740662959        5.1104326527
 Ga         3.2065419758       10.7702654427        7.7896621144
 Ga         5.7932171034        2.9988635081       -0.0070690705
 Ga         5.8692103105        2.6201804807        2.7029301340
 Ga         5.7750039366        2.5218403041        5.3274889947
 Ga         5.6792536505        2.7939553009        7.8695853812
 Ga         5.7509062220        5.4583804436        0.0070519788
 Ga         8.4733797120       10.6262489117        5.2010397340
 Ga         8.5744530324       10.6630840537        2.5838178060
 Ga         5.8821609913        5.4500258866        7.9161587923
 Ga         5.9026697859        8.0525381615       -0.0347067267
 Ga         8.4200501730       10.8579413368        7.7944463561
 Ga         8.3845736538       10.7290095891       -0.1480209800
 Ga         5.9210950687        7.9727416450        7.8605325495
 Ga         5.7534626267       10.9926093518       -0.1493079566
 Ga         5.8365453932       10.5953362380        2.5580430916
 Ga         5.6429168370       10.5540704136        5.1373963091
 Ga         5.8603831642       10.5449492374        7.7587945315
 Ga         8.5539404420        2.8293743150       -0.0814371555
 Ga         8.4720189616        2.6012789667        2.5295343648
 Ga         8.3382538381        2.8036174063        5.4420030458
 Ga         8.2047917140        2.7519896096        7.9235965874
 Ga         8.4291613725        5.4976860564       -0.1542903919
 Ga         8.4594383332        5.5156058615        2.5850929498
 Ga         8.6514747128        5.3896797418        5.2076597070
 Ga         8.6667652188        5.4050473531        7.9094802003
  C         4.3799891691        6.8469667737        3.7438609481
  O         3.2875292843        7.1215036963        3.4223328931
  O         5.4794301459        6.5917355282        3.9934684611
      59
 i =        8, time =        4.000, E =     -4214.1797451067
 Ga         0.4980974823        2.7828661175       -0.0137199079
 Ga         0.6162281203        2.6183286652        2.5011655661
 Ga         0.3769890382        2.7471201974        5.0723189833
 Ga         0.3525662700        2.7458423165        7.8519968168
 Ga         0.2413893000        5.3113063990       -0.1440502586
 Ga         0.4768266536        5.2683957338        2.5422060463
 Ga         0.5089085772        5.3372127765        5.1842244550
 Ga         0.4760410315        5.5010229338        7.8183456598
 Ga         0.5097911113        7.9686680175       -0.0808361268
 Ga         0.5592347085        8.0439083032        2.5496756175
 Ga         0.5053870283        7.9955278553        5.1624850345
 Ga         0.4490464811        8.1781674043        7.6212678227
 Ga         0.5885189779       10.6378053723       -0.1175968845
 Ga         0.6438799982       10.6435806156        2.4497947777
 Ga         0.4936879584       10.6717846199        5.0731047272
 Ga         0.5004992006       10.7634141682        7.7569506735
 Ga         3.0679700532        2.6614983283       -0.1615664519
 Ga         3.1941448785        2.7724803792        2.6365295137
 Ga         2.9944375155        2.7301000162        5.2971779137
 Ga         2.8746979787        2.6708124716        7.8207237651
 Ga         3.0040554494        5.4408921425        0.0368147015
 Ga         8.3133477806        8.0503341275        2.5208171935
 Ga         8.5202345786        8.0346248241       -0.1111023432
 Ga         3.0717706579        5.2795516494        7.9044187990
 Ga         3.0762359085        7.9898989728       -0.1196099149
 Ga         8.4161104161        7.9061539452        7.8319468217
 Ga         8.2687608617        7.9556975311        5.0403017232
 Ga         3.0476351567        7.9885028380        7.7599654517
 Ga         3.2071242214       10.6189116342       -0.2082986297
 Ga         3.1535452322       10.6218131156        2.4725128294
 Ga         3.1005019431       10.5404298934        5.0452466689
 Ga         3.1667643241       10.6355290083        7.6936815909
 Ga         5.7213123232        2.9620164574       -0.0066518083
 Ga         5.7940814145        2.5862604949        2.6709045606
 Ga         5.7027267149        2.4891680328        5.2588552938
 Ga         5.6062413928        2.7587762014        7.7687191903
 Ga         5.6791358558        5.3891928760        0.0064698884
 Ga         8.3683971509       10.4928690823        5.1354412130
 Ga         8.4660355359       10.5287140354        2.5497285436
 Ga         5.8078490015        5.3813448164        7.8166098033
 Ga         5.8282666971        7.9492923135       -0.0347840831
 Ga         8.3128710540       10.7204079803        7.6957318954
 Ga         8.2784292851       10.5933371766       -0.1458887720
 Ga         5.8455933134        7.8720257343        7.7597309902
 Ga         5.6791606309       10.8538481821       -0.1477249363
 Ga         5.7623423475       10.4606624617        2.5264648226
 Ga         5.5720827278       10.4188048574        5.0730807693
 Ga         5.7878771485       10.4120055988        7.6594462969
 Ga         8.4458223168        2.7931405967       -0.0798581094
 Ga         8.3647433529        2.5687439116        2.4984532486
 Ga         8.2331602915        2.7680809987        5.3743096212
 Ga         8.1004041084        2.7183521045        7.8244939066
 Ga         8.3251356511        5.4294089096       -0.1523041979
 Ga         8.3528927771        5.4461736575        2.5509036736
 Ga         8.5421642814        5.3199401199        5.1410827101
 Ga         8.5565155301        5.3365957291        7.8111252082
  C         4.3229361859        6.7596179045        3.7012369180
  O         3.2320545720        7.0377524588        3.3761230412
  O         5.4240264426        6.5081930988        3.9473275916
      59
 i =        9, time =        4.500, E =     -4214.1847975323
 Ga         0.4908480985        2.7483404075       -0.0131076567
 Ga         0.6081433065        2.5856270857        2.4703352491
 Ga         0.3715406772        2.7123255451        5.0124458383
 Ga         0.3464752776        2.7129180740        7.7580446251
 Ga         0.2375744494        5.2467767649       -0.1416686793
 Ga         0.4702050122        5.2054933301        2.5112469954
 Ga         0.5018923093        5.2729201218        5.1192089373
 Ga         0.4688275092        5.4329984076        7.7217011957
 Ga         0.5043754705        7.8701469501       -0.0801391559
 Ga         0.5544435646        7.9446992320        2.5181545761
 Ga         0.5008808558        7.8969348739        5.1000036823
 Ga         0.4430727029        8.0793805374        7.5284067509
 Ga         0.5815924173       10.5065551244       -0.1170194210
 Ga         0.6355616832       10.5145172700        2.4198528348
 Ga         0.4894242535       10.5414218158        5.0131564592
 Ga         0.4949007048       10.6322504737        7.6621723103
 Ga         3.0290535966        2.6300521696       -0.1599521657
 Ga         3.1556409636        2.7388810512        2.6049883064
 Ga         2.9579925739        2.6964306496        5.2315906261
 Ga         2.8407554840        2.6385362533        7.7259323234
 Ga         2.9672508425        5.3764705196        0.0351955473
 Ga         8.2117175065        7.9512538578        2.4915363036
 Ga         8.4162204119        7.9356544170       -0.1127492983
 Ga         3.0340986856        5.2152236491        7.8067557918
 Ga         3.0396568511        7.8914979804       -0.1166264251
 Ga         8.3144661880        7.8109030227        7.7368314545
 Ga         8.1661011875        7.8587570142        4.9791911009
 Ga         3.0105761282        7.8907171376        7.6634613735
 Ga         3.1676629269       10.4897634538       -0.2071488791
 Ga         3.1152367701       10.4915979201        2.4422611495
 Ga         3.0639344587       10.4125734515        4.9828288180
 Ga         3.1287245106       10.5066356524        7.6019231718
 Ga         5.6525336228        2.9267376311       -0.0062564962
 Ga         5.7221208421        2.5537536988        2.6403313256
 Ga         5.6335432673        2.4578500771        5.1930889243
 Ga         5.5362733165        2.7250939748        7.6721581595
 Ga         5.6104584600        5.3229933528        0.0058923466
 Ga         8.2679989434       10.3652688979        5.0726492249
 Ga         8.3622763402       10.4001592000        2.5170476454
 Ga         5.7367144646        5.3156034602        7.7213517029
 Ga         5.7570449919        7.8504288499       -0.0348820784
 Ga         8.2102883203       10.5887689971        7.6012684368
 Ga         8.1768468573       10.4635010434       -0.1438534209
 Ga         5.7732765119        7.7756269588        7.6632026876
 Ga         5.6079910955       10.7210467991       -0.1462361776
 Ga         5.6913005703       10.3317382391        2.4962636678
 Ga         5.5043197443       10.2892757337        5.0115366571
 Ga         5.7185149472       10.2847957952        7.5643306863
 Ga         8.3423505551        2.7584208517       -0.0783573054
 Ga         8.2620829341        2.5376084193        2.4687674508
 Ga         8.1326119944        2.7340444226        5.3095060119
 Ga         8.0005002070        2.6861782789        7.7297255874
 Ga         8.2256799125        5.3641072070       -0.1504194450
 Ga         8.2509329768        5.3797141383        2.5181239791
 Ga         8.4375549337        5.2531422186        5.0773236455
 Ga         8.4509800810        5.2710696681        7.7170611091
  C         4.2677415854        6.6760824722        3.6605584669
  O         3.1768923732        6.9582057820        3.3313448562
  O         5.3734576814        6.4277585275        3.9037920702
      59
 i =       10, time =        5.000, E =     -4214.1772627383
 Ga         0.4842046889        2.7173862623       -0.0125453742
 Ga         0.6008281196        2.5562840859        2.4427638086
 Ga         0.3665462270        2.6810553894        4.9591633332
 Ga         0.3407865645        2.6835414518        7.6742964563
 Ga         0.2340468197        5.1891569782       -0.1394915381
 Ga         0.4641864313        5.1494445161        2.4835919854
 Ga         0.4955185753        5.2155653053        5.0608916427
 Ga         0.4621887743        5.3721081533        7.6352084216
 Ga         0.4995890986        7.7819390574       -0.0795751140
 Ga         0.5503817629        7.8558917286        2.4899414217
 Ga         0.4970310089        7.8086883387        5.0441899481
 Ga         0.4376480261        7.9911915053        7.4454773695
 Ga         0.5754020775       10.3891103586       -0.1166326283
 Ga         0.6280343861       10.3992873303        2.3931011829
 Ga         0.4857840172       10.4249164162        4.9597948276
 Ga         0.4899313886       10.5150728591        7.5774719101
 Ga         2.9941259276        2.6020495238       -0.1585645514
 Ga         3.1212966246        2.7088691739        2.5768718069
 Ga         2.9254504612        2.6662923598        5.1728399812
 Ga         2.8105836906        2.6096995856        7.6413186018
 Ga         2.9343446986        5.3191014789        0.0336124969
 Ga         8.1208615818        7.8625792673        2.4655188185
 Ga         8.3232796539        7.8470817063       -0.1145844302
 Ga         3.0004304655        5.1577544836        7.7193413371
 Ga         3.0071019631        7.8034544169       -0.1137978901
 Ga         8.2237784096        7.7259242493        7.6518860901
 Ga         8.0741577048        7.7721068966        4.9246403815
 Ga         2.9774920001        7.8032704146        7.5770194594
 Ga         3.1323507861       10.3744022700       -0.2062999378
 Ga         3.0810475447       10.3751609777        2.4152120002
 Ga         3.0313864410       10.2983958857        4.9269449884
 Ga         3.0948010267       10.3915606157        7.5201764692
 Ga         5.5911767572        2.8952489571       -0.0058862016
 Ga         5.6576479456        2.5245823212        2.6132348767
 Ga         5.5717250102        2.4297355430        5.1341035317
 Ga         5.4735208790        2.6949702121        7.5856978945
 Ga         5.5491317635        5.2638119197        0.0053182069
 Ga         8.1784734309       10.2513115582        5.0165055464
 Ga         8.2695086494       10.2853044437        2.4876615890
 Ga         5.6731004078        5.2568268087        7.6362360137
 Ga         5.6933645588        7.7618753745       -0.0350338930
 Ga         8.1185130147       10.4710390982        7.5168125471
 Ga         8.0860170491       10.3474252609       -0.1420236088
 Ga         5.7085042611        7.6894327457        7.5767307062
 Ga         5.5441816000       10.6023257599       -0.1449593511
 Ga         5.6277244526       10.2163756076        2.4693370608
 Ga         5.4438043994       10.1732482228        4.9565658039
 Ga         5.6566435415       10.1711144630        7.4791620545
 Ga         8.2498434050        2.7272941776       -0.0769912722
 Ga         8.1702941108        2.5097959454        2.4423600933
 Ga         8.0427742497        2.7035721350        5.2516202532
 Ga         7.9111326304        2.6575126036        7.6451640102
 Ga         8.1370567685        5.3058564473       -0.1487527849
 Ga         8.1598102279        5.3203007440        2.4886404433
 Ga         8.3440357720        5.1932433532        5.0202168609
 Ga         8.3565507338        5.2124569384        7.6331537971
  C         4.2176446386        6.6013893076        3.6246700917
  O         3.1243198461        6.8882008580        3.2904930899
  O         5.3318984646        6.3553131073        3.8658533687
      59
 i =       11, time =        5.500, E =     -4214.1628484758
 Ga         0.4785414559        2.6920834257       -0.0120496011
 Ga         0.5947428103        2.5322570559        2.4203240169
 Ga         0.3622878307        2.6553659480        4.9162544202
 Ga         0.3357685815        2.6597604243        7.6066152300
 Ga         0.2309879400        5.1424175477       -0.1376328747
 Ga         0.4591304364        5.1041814916        2.4611411233
 Ga         0.4901718573        5.1691347430        5.0131568749
 Ga         0.4564841554        5.3224695327        7.5647217040
 Ga         0.4958052234        7.7100079697       -0.0792060783
 Ga         0.5474577888        7.7835037478        2.4669441667
 Ga         0.4942067129        7.7367705846        4.9988986573
 Ga         0.4331064946        7.9197089320        7.3781818128
 Ga         0.5703831505       10.2934338623       -0.1165240452
 Ga         0.6217770948       10.3058477483        2.3713720591
 Ga         0.4831235603       10.3302504261        4.9168029858
 Ga         0.4859602490       10.4199312452        7.5086520397
 Ga         2.9654895505        2.5794730448       -0.1575248405
 Ga         3.0934980192        2.6845167202        2.5541471093
 Ga         2.8990501514        2.6417283060        5.1248895053
 Ga         2.7863275824        2.5862939849        7.5727307358
 Ga         2.9075831666        5.2728403299        0.0320989594
 Ga         8.0469947574        7.7903315212        2.4446395747
 Ga         8.2477858660        7.7749181015       -0.1166793223
 Ga         2.9730647446        5.1110914568        7.6480917672
 Ga         2.9808685793        7.7317478203       -0.1112214623
 Ga         8.1503381022        7.6571241011        7.5829660486
 Ga         7.9991207699        7.7016922307        4.8804188042
 Ga         2.9506624856        7.7321354874        7.5064496139
 Ga         3.1035854813       10.2807672890       -0.2059039348
 Ga         3.0533355889       10.2804464611        2.3932124144
 Ga         3.0051673941       10.2057731300        4.8813725125
 Ga         3.0673586968       10.2982542062        7.4541859840
 Ga         5.5415137840        2.8697547244       -0.0055494472
 Ga         5.6050005797        2.5006838241        2.5916003903
 Ga         5.5215316322        2.4066891037        5.0858376348
 Ga         5.4221795313        2.6704646685        7.5151597105
 Ga         5.4993976636        5.2156819055        0.0047553353
 Ga         8.1060710398       10.1588436655        4.9708497653
 Ga         8.1940668425       10.1920269998        2.4634832764
 Ga         5.6213501082        5.2090367699        7.5671057868
 Ga         5.6415825661        7.6895865879       -0.0352632124
 Ga         8.0437699183       10.3752394202        7.4481244662
 Ga         8.0121341506       10.2530356546       -0.1405127218
 Ga         5.6556494485        7.6193303105        7.5061252541
 Ga         5.4919892951       10.5058034795       -0.1440064328
 Ga         5.5759268826       10.1224008444        2.4475688123
 Ga         5.3947044847       10.0785222894        4.9119596737
 Ga         5.6065822358       10.0787501924        7.4096788661
 Ga         8.1746196282        2.7018491562       -0.0758256207
 Ga         8.0956370656        2.4872239188        2.4210976168
 Ga         7.9698069791        2.6787311763        5.2046620174
 Ga         7.8383662619        2.6343793935        7.5766616619
 Ga         8.0654828231        5.2587104093       -0.1474213891
 Ga         8.0857696840        5.2720028300        2.4643676936
 Ga         8.2679959675        5.1442309932        4.9736109305
 Ga         8.2796326021        5.1647485419        7.5652397810
  C         4.1759712768        6.5405733763        3.5963363455
  O         3.0769546256        6.8329389860        3.2561414912
  O         5.3031437970        6.2957709093        3.8363954867
      59
 i =       12, time =        6.000, E =     -4214.1494720884
 Ga         0.4741094753        2.6738371871       -0.0116313663
 Ga         0.5901977764        2.5148683763        2.4042823839
 Ga         0.3589547216        2.6366457975        4.8862798582
 Ga         0.3316005853        2.6429603341        7.5589682216
 Ga         0.2285189876        5.1092438564       -0.1361696460
 Ga         0.4552787133        5.0723649402        2.4451795397
 Ga         0.4861111159        5.1363251106        4.9786291980
 Ga         0.4519547455        5.2868659971        7.5141991270
 Ga         0.4932767632        7.6583851649       -0.0790743621
 Ga         0.5459505089        7.7316036175        2.4504527031
 Ga         0.4926592740        7.6852259615        4.9667369453
 Ga         0.4296728937        7.8690648797        7.3303765083
 Ga         0.5668297454       10.2249091567       -0.1167544868
 Ga         0.6171125726       10.2395811159        2.3559045242
 Ga         0.4816850782       10.2628219188        4.8867416070
 Ga         0.4832369974       10.3522703643        7.4596370450
 Ga         2.9447001202        2.5636645837       -0.1569156717
 Ga         3.0738592064        2.6672251714        2.5381449478
 Ga         2.8803058468        2.6241197101        5.0904182877
 Ga         2.7694389608        2.5696660131        7.5241250053
 Ga         2.8884850225        5.2404313390        0.0306756107
 Ga         7.9943192101        7.7385811931        2.4301676757
 Ga         8.1940496119        7.7232279019       -0.1190863791
 Ga         2.9535560351        5.0779042262        7.5970071096
 Ga         2.9625115412        7.6804212065       -0.1089609341
 Ga         8.0984011595        7.6084984110        7.5340318858
 Ga         7.9451745980        7.6515333558        4.8490760687
 Ga         2.9316297103        7.6813508975        7.4556780509
 Ga         3.0829875927       10.2142281120       -0.2060658116
 Ga         3.0336953766       10.2128257958        2.3775108042
 Ga         2.9868402250       10.1400320616        4.8486650645
 Ga         3.0479975365       10.2320944662        7.4078394782
 Ga         5.5064346935        2.8517459296       -0.0052514435
 Ga         5.5671108307        2.4833667965        2.5767723038
 Ga         5.4858442134        2.3899704122        5.0509530192
 Ga         5.3850841334        2.6529697025        7.4644787048
 Ga         5.4641253568        5.1813305937        0.0042081216
 Ga         8.0550212037       10.0931722959        4.9382783055
 Ga         8.1402343877       10.1256544170        2.4458042887
 Ga         5.5844003576        5.1749530950        7.5179127506
 Ga         5.6046455551        7.6375875598       -0.0355867712
 Ga         7.9902678910       10.3067938169        7.3990996715
 Ga         7.9593867472       10.1856919110       -0.1393976882
 Ga         5.6176677639        7.5693004133        7.4553132527
 Ga         5.4542911912       10.4369700706       -0.1434540935
 Ga         5.5388241488       10.0551049553        2.4322330776
 Ga         5.3598393552       10.0103693979        4.8802829759
 Ga         5.5712530711       10.0129703765        7.3597605979
 Ga         8.1209522959        2.6834971332       -0.0749041106
 Ga         8.0423449653        2.4711888814        2.4062435719
 Ga         7.9178761417        2.6609185131        5.1713434459
 Ga         7.7863013258        2.6181482714        7.5281778590
 Ga         8.0151652194        5.2254114540       -0.1465049618
 Ga         8.0330349553        5.2375722009        2.4465987055
 Ga         8.2137562152        5.1087997609        4.9401072556
 Ga         8.2245560831        5.1306429337        7.5172677789
  C         4.1450268983        6.4970281410        3.5774381897
  O         3.0366547974        6.7959176932        3.2300566562
  O         5.2896289187        6.2524871675        3.8173405523
      59
 i =       13, time =        6.500, E =     -4214.1447556771
 Ga         0.4711295172        2.6638994682       -0.0112987764
 Ga         0.5874684519        2.5052953645        2.3957672454
 Ga         0.3567134095        2.6261297227        4.8715291672
 Ga         0.3284374739        2.6343783155        7.5348987298
 Ga         0.2267457067        5.0920311874       -0.1351684814
 Ga         0.4528438288        5.0563717064        2.4368537526
 Ga         0.4835646270        5.1195436405        4.9596433951
 Ga         0.4488116961        5.2677767156        7.4871660482
 Ga         0.4922326896        7.6306616177       -0.0792179944
 Ga         0.5461144956        7.7038161268        2.4416161572
 Ga         0.4926180808        7.6576576816        4.9500314727
 Ga         0.4275470881        7.8429472284        7.3054996806
 Ga         0.5650054735       10.1883320773       -0.1173803929
 Ga         0.6143281546       10.2052890324        2.3478035395
 Ga         0.4816904346       10.2274437800        4.8718998152
 Ga         0.4819863074       10.3169457157        7.4339257942
 Ga         2.9331400031        2.5558244848       -0.1568115073
 Ga         3.0638206341        2.6582448058        2.5300539381
 Ga         2.8705678760        2.6146970738        5.0718126548
 Ga         2.7612156357        2.5610177617        7.4990308455
 Ga         2.8784042780        5.2243280377        0.0293563775
 Ga         7.9665821157        7.7109555973        2.4232400581
 Ga         8.1659139303        7.6956325456       -0.1218608363
 Ga         2.9432900088        5.0605740298        7.5696508037
 Ga         2.9534200237        7.6530770213       -0.1070681867
 Ga         8.0717651699        7.5836137153        7.5086162166
 Ga         7.9160449101        7.6252157267        4.8328866225
 Ga         2.9217688497        7.6545169133        7.4282000683
 Ga         3.0720013857       10.1795739737       -0.2068831980
 Ga         3.0235489815       10.1770870508        2.3692203524
 Ga         2.9778027886       10.1059255944        4.8310972708
 Ga         3.0381463380       10.1978792766        7.3846098355
 Ga         5.4885197167        2.8425558611       -0.0049952041
 Ga         5.5465895404        2.4737949131        2.5699558113
 Ga         5.4672331361        2.3806993306        5.0318185025
 Ga         5.3647583012        2.6437271124        7.4371574530
 Ga         5.4458753050        5.1631884264        0.0036782160
 Ga         8.0291006370       10.0590306465        4.9211057700
 Ga         8.1118291153       10.0909362399        2.4357717064
 Ga         5.5648687939        5.1570011583        7.4921815124
 Ga         5.5851806311        7.6094610952       -0.0360211188
 Ga         7.9617561521       10.2705358643        7.3732095828
 Ga         7.9315076202       10.1501710063       -0.1387462733
 Ga         5.5971918817        7.5428913068        7.4277908916
 Ga         5.4336468903       10.4007197148       -0.1433715317
 Ga         5.5190143452       10.0192022753        2.4244684980
 Ga         5.3417232657        9.9734830326        4.8638235904
 Ga         5.5532657008        9.9784709701        7.3328609148
 Ga         8.0926502600        2.6734952126       -0.0742636224
 Ga         8.0141902058        2.4628477142        2.3989268213
 Ga         7.8906959016        2.6513796041        5.1540858386
 Ga         7.7585901506        2.6100440819        7.5032445054
 Ga         7.9898615991        5.2084079533       -0.1460742693
 Ga         8.0053725878        5.2194632433        2.4364818295
 Ga         8.1851684765        5.0893467739        4.9220219226
 Ga         8.1951787863        5.1125454423        7.4927622652
  C         4.1268831006        6.4737765216        3.5696637221
  O         3.0050960694        6.7802571538        3.2138233290
  O         5.2934889236        6.2284681932        3.8103990962
      59
 i =       14, time =        7.000, E =     -4214.1507224895
 Ga         0.4695526160        2.6620092192       -0.0110511812
 Ga         0.5864961613        2.5032921573        2.3945459829
 Ga         0.3555264160        2.6235591871        4.8715320150
 Ga         0.3262437044        2.6337581111        7.5336775591
 Ga         0.2256436147        5.0902847097       -0.1346164818
 Ga         0.4517794741        5.0557122253        2.4359271367
 Ga         0.4824835203        5.1182937012        4.9557139195
 Ga         0.4470083749        5.2646881262        7.4828931693
 Ga         0.4926256562        7.6260929808       -0.0796300773
 Ga         0.5478992243        7.6993901555        2.4401966377
 Ga         0.4940375461        7.6533191034        4.9483007266
 Ga         0.4266858487        7.8405944148        7.3028417904
 Ga         0.5648547666       10.1827101746       -0.1183931792
 Ga         0.6133621748       10.2019812356        2.3468412305
 Ga         0.4830941756       10.2231218756        4.8718065004
 Ga         0.4821613219       10.3129556981        7.4307962074
 Ga         2.9305221054        2.5557056671       -0.1571981833
 Ga         3.0630846967        2.6573173424        2.5296284750
 Ga         2.8695571830        2.6132055551        5.0685777064
 Ga         2.7613907240        2.5600993392        7.4967213459
 Ga         2.8770606307        5.2240243501        0.0281350729
 Ga         7.9630086378        7.7067027541        2.4236227651
 Ga         8.1625853700        7.6913822819       -0.1249963878
 Ga         2.9419807559        5.0586097319        7.5652854118
 Ga         2.9533088170        7.6489703994       -0.1055305073
 Ga         8.0696474921        7.5817344567        7.5059898969
 Ga         7.9109589666        7.6219969998        4.8313817748
 Ga         2.9207963707        7.6508878738        7.4232898046
 Ga         3.0703266825       10.1758159567       -0.2083393269
 Ga         3.0226022908       10.1722393894        2.3681095847
 Ga         2.9777667478       10.1024724649        4.8281985813
 Ga         3.0375108929       10.1946191529        7.3837831029
 Ga         5.4872361744        2.8419079127       -0.0047794653
 Ga         5.5428954357        2.4717250955        2.5709032296
 Ga         5.4651667595        2.3786417064        5.0279422304
 Ga         5.3606766614        2.6424787434        7.4324705374
 Ga         5.4441185215        5.1607531223        0.0031634141
 Ga         8.0275323381       10.0554421879        4.9188528615
 Ga         8.1080621458       10.0868921192        2.4331459545
 Ga         5.5622130097        5.1546789241        7.4891841135
 Ga         5.5826442950        7.6044645960       -0.0365638367
 Ga         7.9574600919       10.2654661744        7.3697373598
 Ga         7.9277249609       10.1454857154       -0.1385458583
 Ga         5.5936750541        7.5393683723        7.4228328476
 Ga         5.4295257106       10.3960409886       -0.1437463333
 Ga         5.5159602858       10.0137162993        2.4240397189
 Ga         5.3398381574        9.9668889793        4.8621092447
 Ga         5.5520811434        9.9742819743        7.3282650983
 Ga         8.0889266225        2.6715818070       -0.0738966672
 Ga         8.0103931149        2.4619605101        2.3989162017
 Ga         7.8874998475        2.6498550045        5.1523878583
 Ga         7.7544769985        2.6098135412        7.5011347512
 Ga         7.9887991312        5.2071944493       -0.1461160655
 Ga         8.0020046098        5.2171678774        2.4337778437
 Ga         8.1814370309        5.0853745914        4.9188742151
 Ga         8.1907024995        5.1099584524        7.4909970391
  C         4.1212505385        6.4701715583        3.5726771281
  O         2.9822332328        6.7852379196        3.2072020731
  O         5.3138776481        6.2231852248        3.8151284896
