%chk=000185837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185837

0 1
O -1.524757 1.886691 0.421825
O -0.552495 -2.099379 0.429138
O 3.961358 -0.772061 -1.012179
O -3.756936 2.094018 0.368944
O -2.203726 -3.483220 -0.258553
C 1.676723 -0.096939 -0.330565
C 0.812803 1.215044 -0.278426
C -0.557063 0.794055 0.245033
C 0.983762 -1.200925 -1.182719
C -1.240528 -0.113758 -0.817397
C -0.506069 -1.448469 -0.883025
C 3.017861 0.319722 -1.016244
C 1.526346 2.305738 0.489335
C 1.964902 -0.653144 1.067879
C 3.760082 1.423577 -0.246551
C -2.691798 0.017254 -0.459345
C 2.864892 2.398127 0.449511
C -2.811290 1.395716 0.137196
C 0.679886 3.290509 1.220055
C -3.696849 -0.832246 -0.625675
C -1.466001 -3.115050 0.626012
C -1.345753 -3.608971 2.022342
H 0.691995 1.614977 -1.321262
H -0.491417 0.311538 1.245769
H 1.530339 -2.154626 -1.026720
H 1.077837 -0.961979 -2.259973
H -1.130978 0.357954 -1.837510
H -0.966546 -2.139872 -1.627290
H 2.842782 0.612832 -2.074016
H 2.825827 -1.336202 1.042081
H 2.216162 0.140908 1.781251
H 1.110396 -1.209417 1.473600
H 4.443714 1.957976 -0.937917
H 4.429837 0.934902 0.501067
H 3.392834 3.204851 0.956558
H 0.199823 2.829102 2.096745
H -0.148564 3.659136 0.589741
H 1.239618 4.164690 1.571154
H 3.629920 -1.523182 -1.534944
H -3.570325 -1.828331 -1.048183
H -4.719313 -0.601906 -0.342527
H -0.503419 -3.149932 2.565087
H -1.205258 -4.702174 2.041127
H -2.264513 -3.393332 2.593068


%chk=000185837-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185837

0 1
O -1.587716 1.977409 0.322502
O -0.629276 -2.163654 0.521373
O 3.938555 -0.804326 -1.175135
O -3.924625 2.047197 0.328209
O -1.971528 -3.817156 -0.447991
C 1.690040 -0.068665 -0.267590
C 0.819218 1.259246 -0.251132
C -0.574332 0.862902 0.252189
C 0.995937 -1.196428 -1.100614
C -1.236017 -0.125048 -0.739999
C -0.498312 -1.462754 -0.795426
C 3.021463 0.336142 -0.986309
C 1.558504 2.404108 0.459947
C 2.006333 -0.593963 1.159585
C 3.809259 1.375191 -0.176533
C -2.704136 -0.000842 -0.395728
C 2.920808 2.438258 0.437371
C -2.882489 1.405288 0.118420
C 0.757010 3.522456 1.097266
C -3.730815 -0.874447 -0.526715
C -1.402514 -3.337334 0.558005
C -1.450361 -3.886675 1.964751
H 0.679956 1.578381 -1.311424
H -0.526014 0.429385 1.267573
H 1.552286 -2.142866 -0.966933
H 1.046427 -0.935306 -2.180669
H -1.104277 0.327649 -1.749667
H -0.935369 -2.130233 -1.561469
H 2.749246 0.761007 -1.980049
H 2.824897 -1.333736 1.093971
H 2.332101 0.221359 1.826573
H 1.136283 -1.094354 1.612103
H 4.578464 1.836819 -0.825078
H 4.371119 0.840050 0.616784
H 3.435396 3.286194 0.910230
H 0.118012 3.153441 1.920708
H 0.064259 3.989865 0.373863
H 1.428721 4.301058 1.499437
H 3.593605 -1.387168 -1.897451
H -3.587419 -1.889115 -0.913680
H -4.742807 -0.568737 -0.236488
H -0.456057 -3.840610 2.437510
H -1.819318 -4.922354 1.946453
H -2.138417 -3.273432 2.574754


