%chk=000195592.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195592

0 1
O -0.351853 0.778052 0.209729
O -1.760235 -0.943815 -0.103191
O 2.772320 1.014088 1.112741
O 0.678792 -2.100007 -0.577395
O 2.631039 1.693291 -1.112142
O 3.298485 -1.279890 -1.200857
O -2.518850 1.410843 1.560915
O -4.991715 1.478096 0.635519
O -5.340236 -1.209132 -0.594216
O 5.660329 -1.074595 0.239222
C 0.895392 0.317327 -0.378101
C 1.262051 -1.063022 0.203101
C -1.538219 0.435718 -0.483322
C 2.790420 -1.290673 0.130642
C -2.626746 1.337801 0.140120
C -4.044260 0.802026 -0.181609
C 1.890234 1.410874 0.080676
C 3.505755 -0.229314 0.999034
C -4.171698 -0.720344 0.076589
C -3.015360 -1.518432 -0.570810
C 4.913523 0.117379 0.471930
C -2.954508 -2.957498 -0.101396
C 3.399992 2.916132 -1.076146
H 0.812059 0.277310 -1.488262
H 0.895840 -1.140154 1.254872
H -1.440479 0.506515 -1.582788
H 3.040125 -2.330568 0.460396
H -2.516279 2.401013 -0.182862
H -4.365557 1.053300 -1.219529
H 1.402151 2.310919 0.516605
H 3.545283 -0.555218 2.065721
H -4.264379 -0.927277 1.165022
H -3.055198 -1.438058 -1.679710
H 5.504646 0.657535 1.234553
H 4.854701 0.719541 -0.452457
H -2.244167 -3.552142 -0.690652
H -2.646772 -3.033452 0.950483
H -3.944540 -3.432387 -0.196101
H -0.317006 -2.078876 -0.464016
H 3.120395 -0.409596 -1.641965
H -2.042324 0.612603 1.908953
H -4.617111 1.614536 1.551112
H -6.130072 -0.699299 -0.290612
H 4.002011 2.854250 -1.990744
H 4.033910 2.945025 -0.183581
H 2.721163 3.773497 -1.110953
H 5.282947 -1.553521 -0.547917


%chk=000195592-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195592

0 1
O -0.369413 0.778695 0.334345
O -1.800437 -1.044270 -0.108879
O 2.850701 1.168871 1.068600
O 0.677554 -2.170765 -0.297034
O 2.646181 1.588663 -1.318177
O 3.348541 -1.099789 -1.248630
O -2.665048 1.180948 1.775493
O -5.140916 1.433180 0.665534
O -5.502466 -1.233128 -0.443238
O 5.694745 -1.187665 0.262323
C 0.900696 0.309323 -0.282251
C 1.349984 -1.044855 0.312568
C -1.583943 0.399899 -0.326443
C 2.875606 -1.196178 0.145375
C -2.698940 1.254488 0.313134
C -4.091066 0.744246 -0.094964
C 1.942815 1.427070 -0.028616
C 3.569504 -0.157666 1.060022
C -4.222740 -0.781432 0.101573
C -3.106934 -1.530681 -0.652007
C 5.057819 0.062699 0.670566
C -3.142308 -3.042187 -0.455103
C 3.469898 2.810703 -1.396299
H 0.748760 0.197670 -1.373706
H 1.141629 -0.998513 1.406720
H -1.526954 0.582190 -1.425926
H 3.157514 -2.212493 0.459920
H -2.560093 2.304541 -0.017770
H -4.295182 0.985734 -1.154478
H 1.441385 2.371615 0.251121
H 3.490071 -0.500001 2.107385
H -4.140272 -1.010178 1.185342
H -3.163124 -1.274346 -1.733243
H 5.630912 0.426304 1.537819
H 5.112307 0.824545 -0.133112
H -2.354788 -3.539387 -1.047360
H -2.998017 -3.295956 0.609839
H -4.126228 -3.423377 -0.775269
H -0.310639 -1.998805 -0.221501
H 3.200999 -0.160640 -1.572617
H -1.718124 1.212849 2.068520
H -4.810860 1.504831 1.602062
H -6.197479 -0.614020 -0.095506
H 4.014406 2.748834 -2.350410
H 4.180946 2.864857 -0.552590
H 2.816520 3.703863 -1.393588
H 5.222477 -1.469880 -0.572940


