%chk=000224007.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224007

0 1
O 4.185286 0.622422 0.071881
O -0.062864 -2.235866 -0.734990
O -6.070079 -0.397939 1.819832
O 4.247905 -0.936526 1.708845
C 0.616191 1.445778 -0.065164
C 1.701303 0.323260 -0.054019
C -0.663801 0.961715 -0.759580
C -1.235412 -0.205148 0.098221
C -2.588150 -0.720394 -0.489894
C 1.183007 -0.829034 0.814238
C -0.204367 -1.334546 0.369162
C 2.898555 1.120544 0.553363
C 1.361435 2.679213 -0.606915
C -1.679611 2.113830 -0.887470
C 2.787465 2.548486 -0.022481
C -3.511849 0.501512 -0.505620
C 2.094582 -0.171484 -1.451783
C -3.048081 1.627731 -1.388286
C -3.187624 -1.864044 0.371853
C -2.442818 -1.261791 -1.922925
C -3.899225 -1.384039 1.633167
C -4.601283 0.620651 0.267255
C -4.986414 -0.386665 1.276271
C 4.770112 -0.429431 0.745077
C 6.083582 -0.745829 0.081705
C 6.234838 -2.247594 -0.117935
H 0.346208 1.676346 0.999970
H -0.429665 0.583627 -1.782359
H -1.477619 0.218878 1.109709
H 1.144198 -0.526454 1.878082
H 1.901187 -1.676928 0.795514
H -0.619012 -2.026723 1.147105
H 2.915527 1.087943 1.660226
H 0.879978 3.618933 -0.294949
H 1.382222 2.688835 -1.709328
H -1.284671 2.883456 -1.577073
H -1.807081 2.619526 0.090251
H 3.558897 2.704063 -0.799651
H 2.978046 3.304096 0.755905
H 2.920128 -0.892210 -1.389306
H 1.257777 -0.660450 -1.970828
H 2.442973 0.650957 -2.087901
H -2.984269 1.294663 -2.444021
H -3.769353 2.469205 -1.391003
H -2.392925 -2.592150 0.633521
H -3.909528 -2.441855 -0.243183
H -1.888350 -2.214129 -1.917453
H -3.419019 -1.450176 -2.382120
H -1.894581 -0.574924 -2.574720
H -3.193007 -0.908648 2.341611
H -4.337348 -2.240952 2.184132
H 0.369987 -1.785175 -1.500983
H -5.264108 1.484913 0.218078
H 6.170761 -0.205926 -0.886641
H 6.903287 -0.351336 0.722531
H 5.501108 -2.640982 -0.832653
H 7.232915 -2.496858 -0.498309
H 6.093954 -2.794678 0.826536


%chk=000224007-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224007

0 1
O 4.213172 0.388423 -0.118582
O -0.222168 -2.282095 -1.278975
O -5.637283 -0.424824 2.592545
O 4.285400 -0.836764 1.873981
C 0.620630 1.385682 -0.265636
C 1.679852 0.245183 -0.403558
C -0.759372 1.012576 -0.846465
C -1.282349 -0.268327 -0.107251
C -2.746567 -0.662681 -0.582632
C 1.166468 -0.992800 0.370786
C -0.257012 -1.447547 -0.055749
C 2.892349 0.974291 0.250264
C 1.362576 2.647861 -0.778921
C -1.752857 2.194883 -0.689907
C 2.833752 2.436146 -0.282418
C -3.598381 0.578876 -0.276103
C 2.028168 -0.081765 -1.884061
C -3.223069 1.823912 -1.050041
C -3.318578 -1.904244 0.165494
C -2.828374 -0.990760 -2.107307
C -3.730495 -1.631795 1.626631
C -4.531393 0.616033 0.729284
C -4.732405 -0.477615 1.703595
C 4.810702 -0.500143 0.789028
C 6.161650 -0.954853 0.257793
C 6.839718 -1.999875 1.161171
H 0.464136 1.529101 0.829819
H -0.650997 0.799455 -1.930385
H -1.384270 0.038559 0.960012
H 1.143479 -0.749313 1.452494
H 1.846148 -1.857612 0.257589
H -0.611848 -2.171791 0.698314
H 2.804265 0.924191 1.351832
H 0.923878 3.581996 -0.388178
H 1.319815 2.703469 -1.883136
H -1.423189 3.045341 -1.316641
H -1.728871 2.539979 0.364706
H 3.566379 2.560311 -1.098788
H 3.108515 3.151862 0.511282
H 2.627826 -1.006293 -1.944202
H 1.126426 -0.207449 -2.514215
H 2.624310 0.721401 -2.349852
H -3.300290 1.655738 -2.141263
H -3.893869 2.664164 -0.795080
H -2.598479 -2.738756 0.104790
H -4.220117 -2.235860 -0.387418
H -2.387411 -1.983519 -2.290827
H -3.886735 -1.007750 -2.428950
H -2.299189 -0.261032 -2.743200
H -2.849298 -1.356876 2.243439
H -4.180584 -2.523887 2.096473
H 0.189402 -1.766736 -2.016066
H -5.134297 1.518456 0.896288
H 6.011564 -1.342723 -0.767732
H 6.796423 -0.054557 0.144094
H 6.224541 -2.912122 1.245078
H 7.825421 -2.279885 0.749834
H 6.984083 -1.605943 2.181425


