%chk=000253385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253385

0 1
O 5.893128 -0.781887 1.022254
O -5.694230 0.215043 0.359183
C 2.172083 0.590323 -0.339196
C 0.656948 0.625158 -0.186684
C 2.687646 -0.830697 -0.567763
C 2.815537 1.153884 0.956820
C -0.135587 -0.461778 -0.308977
C 1.777392 -1.730875 -1.349561
C 0.412651 -1.819946 -0.655242
C 0.046406 1.967466 0.128957
C 2.578107 1.423238 -1.571841
C 4.336150 1.016613 0.969911
C -1.342825 2.119308 -0.507215
C -1.594299 -0.355079 -0.109419
C 3.883572 -1.244887 -0.122620
C -2.205013 0.924096 -0.212080
C 4.802545 -0.392517 0.656797
C -2.394212 -1.463418 0.191976
C -3.579621 1.068546 -0.054390
C -3.777339 -1.341113 0.363893
C -4.354462 -0.074161 0.230583
C -6.596958 -0.875814 0.662546
H 2.385763 0.620241 1.829267
H 2.543465 2.217942 1.086922
H 1.655907 -1.328336 -2.378526
H 2.206557 -2.744769 -1.474841
H 0.502599 -2.423456 0.273684
H -0.293573 -2.366266 -1.313939
H -0.033930 2.073245 1.232662
H 0.696870 2.796212 -0.213257
H 3.647123 1.323550 -1.790771
H 2.023616 1.107255 -2.463037
H 2.370981 2.488354 -1.421023
H 4.744861 1.328218 1.953391
H 4.802022 1.706928 0.235917
H -1.247216 2.224698 -1.610155
H -1.817667 3.055698 -0.154542
H 4.255985 -2.254662 -0.301729
H -1.944591 -2.450522 0.305483
H -4.070488 2.034779 -0.138657
H -4.371592 -2.216663 0.596711
H -6.346607 -1.318009 1.631013
H -6.581620 -1.616646 -0.141781
H -7.565385 -0.360191 0.704178


%chk=000253385-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253385

0 1
O 5.844723 -0.902868 1.315395
O -5.770476 0.211753 0.514525
C 2.209635 0.607482 -0.387445
C 0.670473 0.660559 -0.286786
C 2.702755 -0.834345 -0.553623
C 2.824706 1.211998 0.919950
C -0.146703 -0.438824 -0.414753
C 1.819565 -1.730891 -1.386989
C 0.408488 -1.816266 -0.755718
C 0.047269 2.007920 0.080414
C 2.683731 1.423363 -1.641350
C 4.351833 1.014642 1.018955
C -1.359872 2.168770 -0.530841
C -1.608895 -0.320036 -0.177172
C 3.867025 -1.287351 0.010895
C -2.232073 0.970219 -0.199247
C 4.766303 -0.445507 0.824693
C -2.426562 -1.450040 0.075027
C -3.610085 1.097594 0.034081
C -3.814231 -1.330714 0.313488
C -4.407885 -0.046273 0.293398
C -6.638168 -0.934692 0.791689
H 2.342155 0.719391 1.787024
H 2.585082 2.289563 0.984169
H 1.715670 -1.306877 -2.406776
H 2.262259 -2.737612 -1.489460
H 0.451556 -2.446930 0.156441
H -0.273067 -2.331469 -1.459795
H -0.019449 2.091510 1.186859
H 0.689008 2.843900 -0.253534
H 3.785280 1.434321 -1.717246
H 2.282167 0.982887 -2.570803
H 2.333102 2.469506 -1.584201
H 4.739081 1.357929 1.995036
H 4.877601 1.616302 0.249663
H -1.260297 2.246596 -1.634835
H -1.831096 3.105605 -0.181929
H 4.191511 -2.325291 -0.138288
H -1.980921 -2.449925 0.105855
H -4.096015 2.078933 0.016711
H -4.406911 -2.228079 0.513772
H -6.325854 -1.462812 1.713786
H -6.649156 -1.646311 -0.056961
H -7.642563 -0.508528 0.930829


