%chk=000227454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227454

0 1
O -1.242235 -2.961310 -1.115331
O 2.417952 0.036433 -2.241797
C -2.218649 0.354096 0.040518
C -1.464635 -0.730414 -0.514994
C -3.504636 0.097194 0.593122
C -2.043432 -2.001017 -0.540398
C -4.036586 -1.228165 0.566668
C -1.737798 1.705184 0.036492
C -3.331920 -2.263163 0.005506
C -4.256704 1.174267 1.163060
C -0.114800 -0.567787 -1.069348
C -2.482993 2.717789 0.583542
C -3.758128 2.451208 1.164063
C 0.908577 0.004350 -0.416689
C 2.246667 0.119065 -1.039862
C 3.400144 0.369907 -0.114945
C 3.447161 -0.197794 1.165349
C 4.461090 1.168787 -0.566358
C -1.767982 -4.303219 -1.258535
C 4.546046 0.043972 1.994424
C 5.554129 1.415861 0.268383
C 5.596175 0.854090 1.548642
H -5.022851 -1.404599 0.999711
H -0.771683 1.918108 -0.423198
H -3.744261 -3.267491 -0.019747
H -5.233811 0.956212 1.592764
H 0.025035 -0.997991 -2.073913
H -2.115293 3.743890 0.579732
H -4.321398 3.275584 1.596483
H 0.802550 0.408875 0.589577
H 2.633742 -0.835384 1.513045
H 4.426864 1.586428 -1.575239
H -1.955733 -4.744744 -0.275973
H -0.934124 -4.810892 -1.763771
H -2.661647 -4.299399 -1.888638
H 4.584620 -0.399365 2.987693
H 6.374365 2.040466 -0.080983
H 6.449283 1.044568 2.198446


%chk=000227454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227454

0 1
O -1.441038 -3.041270 -1.434726
O 2.592954 -0.790823 -1.896900
C -2.184817 0.207294 0.223981
C -1.462033 -0.861475 -0.446979
C -3.558000 -0.008966 0.643087
C -2.173236 -2.055605 -0.762750
C -4.195759 -1.253470 0.341784
C -1.627151 1.512926 0.443848
C -3.531497 -2.251419 -0.367878
C -4.271743 1.029585 1.326595
C -0.050601 -0.810900 -0.836393
C -2.351962 2.513835 1.097776
C -3.678888 2.269260 1.568031
C 0.986851 -0.156269 -0.216330
C 2.362326 -0.237038 -0.768825
C 3.504755 0.363676 0.013408
C 3.383483 0.834876 1.349535
C 4.772037 0.442875 -0.626805
C -2.122033 -4.273456 -1.843575
C 4.501455 1.372545 2.024223
C 5.885740 0.984740 0.043276
C 5.754070 1.453306 1.373473
H -5.230474 -1.410980 0.668184
H -0.634070 1.744874 0.053227
H -4.045636 -3.187842 -0.599777
H -5.303467 0.835395 1.643946
H 0.229319 -1.430932 -1.699137
H -1.902118 3.503047 1.238328
H -4.230475 3.059145 2.088730
H 0.827796 0.396143 0.713231
H 2.428776 0.771577 1.881335
H 4.848242 0.065778 -1.652060
H -2.465265 -4.852126 -0.964874
H -1.357948 -4.846972 -2.387741
H -2.977288 -4.060590 -2.513044
H 4.396420 1.725609 3.056132
H 6.854809 1.043193 -0.464597
H 6.619568 1.874056 1.897760


