Mn Zn  H  C  O                          
   1.00000000000000     
   -15.9882163290000001    0.0509788330000000   -9.1475593970000002
   -16.0602862880000004    0.0000736690000000    9.2723890210000004
   -10.7069010779999996   15.1417245479999991    0.0000460490000000
   Mn   Zn   H    C    O 
     2     6    24    48    26
Direct
  0.1161879395187810  0.2946169002238079  0.2946193583274166
  0.8838150720684226  0.7053833020643765  0.7053801659313947
  0.2945846283039231  0.1191911690534440  0.2931121633249703
  0.2945836121100243  0.2931116882969675  0.1191918973474628
  0.2945839253904623  0.2931154474891855  0.2931166029121428
  0.7054163581488382  0.8808081138310868  0.7068880281832435
  0.7054167465592300  0.7068835251262726  0.7068835896564423
  0.7054158400984178  0.7068882379328656  0.8808096201765920
  0.9369810634957574  0.1642164963310719  0.4494026872304744
  0.1649199942410036  0.9260617187044247  0.4545112630531563
  0.4519058119466237  0.4521275286049047  0.9321440907576459
  0.4519040782360477  0.4521231630726632  0.1638254045725560
  0.4519056017292300  0.9321465881297044  0.1638237244131062
  0.4519057303694041  0.1638263432057769  0.9321441728499238
  0.9369801591883089  0.4494020857016565  0.4494019631889969
  0.1649199655777664  0.4545089988800939  0.4545095948335671
  0.1649203650537245  0.4545092080746755  0.9260615608586633
  0.9369801745291824  0.4494013601903575  0.1642178028881105
  0.4519068344468380  0.9321442155272379  0.4521264156616311
  0.4519038243378901  0.1638257682690565  0.4521228991998001
  0.0630199229570039  0.8357827865534659  0.5505975042777393
  0.8350802250895981  0.0739378858527573  0.5454895914629745
  0.5480963634819176  0.5478766608812791  0.8361747887670248
  0.5480949442744176  0.5478726056181031  0.0678561015215706
  0.5480933770394003  0.0678564597651814  0.5478737784489525
  0.5480955279104762  0.8361751378236875  0.5478772978025219
  0.0630188789048489  0.5505970941628462  0.8357837159856842
  0.8350792252707393  0.5454897759443540  0.0739392957782172
  0.8350788497801744  0.5454913775468242  0.5454912644056691
  0.0630185640539196  0.5505981998529350  0.5505982359340678
  0.5480940953337878  0.0678557366194568  0.8361738297143830
  0.5480946878154569  0.8361766929538561  0.0678540392729943
  0.9636413988642403  0.0922712792209737  0.4720431854287455
  0.0927136053409114  0.9576325288203620  0.4748285439993296
  0.4733258946077612  0.4734510667694849  0.9611841421009046
  0.4733262540924983  0.4734481885061896  0.0920400775397496
  0.4733262641377110  0.9611865784427565  0.0920383649401444
  0.4733268121270484  0.0920410979985178  0.9611840134046616
  0.9636412891633839  0.4720438479152591  0.4720446402251923
  0.0927137781941596  0.4748261659109829  0.4748262694268490
  0.0927134616653404  0.4748277697895986  0.9576325701783546
  0.9636409069319996  0.4720421214624295  0.0922721802152324
  0.4733262507393761  0.9611846710327541  0.4734513263578322
  0.4733254543605554  0.0920400237836745  0.4734489534191084
  0.0363589507380198  0.9077284538606420  0.5279563477946567
  0.9072865218739850  0.0423669848645005  0.5251716504006225
  0.5266759061012039  0.5265511738470963  0.9079601100163472
  0.5266758589671596  0.5265478944424018  0.0388153863993921
  0.5266741831342259  0.0388162236564114  0.5265482065762015
  0.5266744426226069  0.9079603412396651  0.5265512417518465
  0.0363581465020317  0.5279563328907741  0.9077293386585623
  0.9072861286591163  0.5251712142294380  0.0423682864585189
  0.9072862569050244  0.5251732569015601  0.5251732648569245
  0.0363586156641489  0.5279554463728502  0.5279562153513169
  0.5266740697758081  0.0388152961093198  0.9079598474721493
  0.5266741507926156  0.9079613970917109  0.0388141968868894
  0.1159680730866341  0.1047666240373317  0.3896333172759796
  0.0565269299844786  0.0502300843957215  0.4466218231112578
  0.3891316771005009  0.3891014511382238  0.1108806233517825
  0.4462946318551246  0.4465175238150820  0.0535939960750085
  0.3891345564421016  0.1108836525426966  0.1108826276968955
  0.4462953394622104  0.0535946730980683  0.0535932636723402
  0.1159677531703593  0.3896335625875125  0.3896352345243344
  0.0565269044893384  0.4466208913878589  0.4466218759180123
  0.1159674548869063  0.3896325261062827  0.1047667592694950
  0.0565265787443892  0.4466214601364413  0.0502304368577526
  0.3891309990199332  0.1108809182406247  0.3891032602411002
  0.4462942752165517  0.0535938287615139  0.4465174669528764
  0.8840317317808299  0.8952336501136884  0.6103662177787967
  0.9434734196177743  0.9497696486858942  0.5533777101121444
  0.6108700843187904  0.6108964393384326  0.8891195655540614
  0.5537067612164179  0.5534821602108480  0.9464068544890125
  0.6108684453441455  0.8891200787244458  0.6108975968774004
  0.5537056217666176  0.9464065362618257  0.5534827282180785
  0.8840321432819280  0.6103653871775236  0.8952347577729327
  0.9434720220705515  0.5533776261584933  0.9497717439635949
  0.8840306555688002  0.6103664126980064  0.6103649656591017
  0.9434729082224820  0.5533783120279310  0.5533783195423112
  0.6108664143219258  0.8891177718123018  0.8891162430002097
  0.5537053089543846  0.9464075117230806  0.9464049476795822
  0.2517597253767434  0.2494142071827952  0.2494146024738981
  0.7482393202129174  0.7505853179056388  0.7505862559943495
  0.0779038121890991  0.1885655202850245  0.3667663247690314
  0.2001895280272805  0.0646671176779350  0.3675717247316825
  0.3670866675782918  0.3669101663669281  0.0716021029662173
  0.3670816461008641  0.3669121519580969  0.1943965871710134
  0.3670875104347573  0.0716067727811449  0.1943980041757243
  0.3670873070198652  0.1943997003793925  0.0716055818351720
  0.0779035112743145  0.3667652532243721  0.3667687609211399
  0.2001875014588492  0.3675730306383329  0.3675742203877306
  0.2001891279879899  0.3675707472304452  0.0646668422875152
  0.0779035139607629  0.3667661408717464  0.1885664701814918
  0.3670847758712128  0.0716032182838546  0.3669120484899011
  0.3670807707201433  0.1943971778588960  0.3669127853986822
  0.9220959084070159  0.8114335922584388  0.6332332105751135
  0.7998108215749724  0.9353326154036807  0.6324278084917196
  0.6329197929709949  0.6330864989847171  0.8056029423896547
  0.6329158531187957  0.6330884731723074  0.9283967625261624
  0.6329146684928588  0.9283977786812159  0.6330888086285995
  0.6329185815282230  0.8056037282338480  0.6330874116036398
  0.9220957618606320  0.6332325328782105  0.8114343875157530
  0.7998101478333979  0.6324279265195116  0.9353340154097367
  0.7998119889055388  0.6324269332436074  0.6324253157274171
  0.9220958566627857  0.6332335113979042  0.6332327568922835
  0.6329136905610042  0.9283938002353764  0.8056008657503853
  0.6329117228810617  0.8056019661795091  0.9283939558219672
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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