%chk=000228921.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228921

0 1
O -2.835615 -0.442812 1.684224
O -2.148905 0.451513 -0.372224
C -3.416574 -1.640071 1.097815
C -3.780861 -1.350021 -0.372296
C -2.605894 -0.706919 -1.120536
C -1.746630 0.166054 0.975685
C -1.535808 1.520288 1.648886
C -0.059435 1.919105 1.702707
C -2.430088 -2.803490 1.238035
C -4.662294 -1.848002 1.960930
C 0.484713 2.282019 0.314122
C -2.998317 -0.132507 -2.474008
C 2.006606 2.472054 0.308615
C 2.788814 1.155209 0.415674
C 2.720858 0.329071 -0.875739
C 3.480753 -0.999822 -0.765442
C 5.005812 -0.827560 -0.820096
C 5.496549 -0.396789 -2.171181
C 6.571150 0.368386 -2.354748
H -4.114750 -2.269214 -0.880952
H -4.644174 -0.653370 -0.394255
H -1.748440 -1.411305 -1.207907
H -0.879087 -0.519693 0.968013
H -2.130623 2.285472 1.104491
H -1.971148 1.480259 2.669705
H 0.542298 1.100510 2.144981
H 0.061775 2.779924 2.388923
H -2.003993 -2.822622 2.249424
H -2.921126 -3.766996 1.069192
H -1.594410 -2.733622 0.535794
H -4.387712 -2.075112 2.998531
H -5.265656 -0.930651 1.996694
H -5.288873 -2.660195 1.584541
H -0.005589 3.207944 -0.044292
H 0.193330 1.500914 -0.419096
H -3.737727 0.672656 -2.360083
H -2.130238 0.316350 -2.973901
H -3.421557 -0.895565 -3.133318
H 2.302741 3.004923 -0.616486
H 2.302389 3.140037 1.140934
H 2.403720 0.559035 1.265507
H 3.846723 1.377588 0.656990
H 3.123280 0.921756 -1.720657
H 1.660854 0.127461 -1.128539
H 3.206149 -1.512317 0.177108
H 3.152578 -1.676805 -1.578342
H 5.497003 -1.788405 -0.555267
H 5.326147 -0.108378 -0.038000
H 4.912331 -0.769498 -3.014813
H 6.929218 0.660757 -3.330183
H 7.174433 0.763156 -1.551560


%chk=000228921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228921

0 1
O -3.222363 -0.168038 1.664667
O -1.566331 0.082933 -0.080887
C -3.884501 -1.346712 1.009734
C -3.551458 -1.319449 -0.509240
C -2.043143 -1.134798 -0.788123
C -1.797651 -0.034498 1.361864
C -1.307269 1.226563 2.070050
C 0.219668 1.467533 1.952850
C -3.435903 -2.659714 1.695668
C -5.381888 -1.097919 1.248398
C 0.634304 2.239927 0.677404
C -1.720450 -0.933388 -2.268858
C 2.165068 2.428596 0.530940
C 2.979994 1.123756 0.325840
C 2.621970 0.361251 -0.971450
C 3.421580 -0.950241 -1.171671
C 4.955145 -0.759204 -1.356701
C 5.308435 0.038069 -2.595349
C 6.083433 1.151791 -2.626571
H -3.908892 -2.253618 -0.985289
H -4.090014 -0.470345 -0.971012
H -1.472145 -2.007077 -0.394013
H -1.253028 -0.941039 1.722956
H -1.869426 2.088711 1.664799
H -1.602414 1.117882 3.130482
H 0.745319 0.491704 1.991858
H 0.564808 2.037738 2.839396
H -3.571212 -2.571568 2.787714
H -4.050424 -3.505513 1.336086
H -2.378265 -2.908129 1.498877
H -5.604803 -1.104732 2.329806
H -5.670226 -0.112521 0.844010
H -5.991486 -1.877819 0.756563
H 0.154561 3.240390 0.705974
H 0.217076 1.724757 -0.205801
H -2.246995 -0.044190 -2.658012
H -0.635925 -0.781109 -2.409656
H -2.032337 -1.814763 -2.858315
H 2.361462 3.101687 -0.329359
H 2.550918 2.952948 1.430767
H 2.841255 0.448310 1.195484
H 4.056132 1.388847 0.310460
H 2.789503 1.030732 -1.839903
H 1.541382 0.115205 -0.965178
H 3.251826 -1.618284 -0.302026
H 3.024456 -1.484943 -2.059684
H 5.418686 -1.765784 -1.432759
H 5.394570 -0.277920 -0.462938
H 4.885946 -0.341966 -3.540492
H 6.304404 1.675250 -3.563936
H 6.521351 1.571400 -1.711825


