%chk=000190141.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190141

0 1
O -1.655186 1.326126 1.083783
O -1.402756 -1.220970 0.624135
O -3.000899 2.691877 2.282259
O -2.948044 -2.069783 2.033419
C -1.320584 0.570162 2.291881
C -0.643374 -0.713065 1.769392
C -0.351562 1.367162 3.163017
C 0.760698 -0.530421 1.255915
C 0.906135 1.757313 2.382465
C 1.516374 0.625069 1.602074
C 1.330918 -1.522042 0.474982
C 2.830688 0.730184 1.171062
C 3.435292 -0.278209 0.379399
C 2.669369 -1.413419 0.022477
C 4.816094 -0.177360 -0.079532
C 3.258534 -2.452671 -0.794304
C 5.359109 -1.214060 -0.875453
C 4.541946 -2.357723 -1.223013
C -2.534321 2.380102 1.208694
C -2.583858 -1.885425 0.892486
C 5.638519 0.933562 0.248128
C 6.703069 -1.123990 -1.326924
C 6.943434 1.005283 -0.199085
C -2.769968 3.005016 -0.114427
C 7.481591 -0.032980 -0.994276
C -3.239968 -2.301074 -0.367512
C -3.668374 4.081924 -0.189261
C -2.119135 2.541432 -1.267650
C -4.384222 -3.111523 -0.283434
C -2.746977 -1.895423 -1.616924
C -3.911310 4.693684 -1.420582
C -2.367000 3.159693 -2.495520
C -5.028999 -3.518152 -1.453136
C -3.398300 -2.306405 -2.782230
C -3.261088 4.233301 -2.571422
C -4.536409 -3.116337 -2.700135
H -2.277944 0.341591 2.817040
H -0.671928 -1.494480 2.572439
H -0.862239 2.279293 3.542076
H -0.085551 0.776081 4.061803
H 0.645982 2.565188 1.658712
H 1.649122 2.199106 3.077101
H 0.740954 -2.397031 0.193891
H 3.420018 1.609383 1.436848
H 2.637593 -3.310705 -1.051164
H 4.992289 -3.136321 -1.837616
H 5.225363 1.735612 0.861740
H 7.110962 -1.927369 -1.938555
H 7.568757 1.859243 0.055708
H 8.512036 0.038686 -1.338547
H -4.169703 4.430912 0.717642
H -1.423496 1.699435 -1.193542
H -4.760936 -3.414557 0.697405
H -1.858031 -1.259834 -1.666174
H -4.607328 5.528852 -1.484220
H -1.862817 2.805217 -3.393186
H -5.916598 -4.146655 -1.393646
H -3.019963 -1.994512 -3.754557
H -3.452511 4.713612 -3.531120
H -5.042864 -3.435006 -3.611527


%chk=000190141-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190141

0 1
O -1.574087 1.503227 0.927500
O -1.514410 -1.276874 0.508366
O -3.272979 2.636060 2.058088
O -2.844159 -2.359185 2.095646
C -1.385179 0.620533 2.115156
C -0.722787 -0.669639 1.614310
C -0.458315 1.305188 3.136575
C 0.709841 -0.484538 1.137134
C 0.877241 1.714540 2.477656
C 1.492526 0.620554 1.609891
C 1.299070 -1.430213 0.287868
C 2.840052 0.713809 1.224304
C 3.465799 -0.236060 0.366212
C 2.661336 -1.331002 -0.117097
C 4.871304 -0.145380 -0.042229
C 3.243929 -2.317667 -0.999646
C 5.411682 -1.151884 -0.924683
C 4.566084 -2.230838 -1.388393
C -2.575354 2.475591 1.024948
C -2.577787 -2.108451 0.892851
C 5.741668 0.900577 0.394219
C 6.779280 -1.075621 -1.332954
C 7.080673 0.957114 -0.017446
C -2.697107 3.270740 -0.230994
C 7.607812 -0.038139 -0.889439
C -3.316818 -2.641955 -0.285437
C -3.655364 4.317083 -0.267769
C -1.891461 3.004836 -1.369266
C -4.380753 -3.551428 -0.048938
C -2.989854 -2.260744 -1.613349
C -3.806591 5.093209 -1.434722
C -2.046800 3.785220 -2.534276
C -5.109367 -4.080135 -1.133320
C -3.723255 -2.792495 -2.694610
C -3.002380 4.828955 -2.569619
C -4.781494 -3.702228 -2.457795
H -2.376961 0.411148 2.551436
H -0.759564 -1.383409 2.463322
H -0.970913 2.183444 3.564522
H -0.280206 0.592393 3.965911
H 0.698472 2.602669 1.839517
H 1.596804 2.029560 3.256212
H 0.695781 -2.264741 -0.085947
H 3.417233 1.564941 1.602652
H 2.610712 -3.139714 -1.353458
H 5.001570 -2.982535 -2.057304
H 5.367138 1.679727 1.065399
H 7.172351 -1.849195 -2.003590
H 7.725143 1.770513 0.333661
H 8.654691 0.010771 -1.208022
H -4.266415 4.499934 0.622383
H -1.159570 2.193318 -1.327524
H -4.617006 -3.826009 0.984456
H -2.174538 -1.551564 -1.780476
H -4.546710 5.900104 -1.462564
H -1.425696 3.581769 -3.413301
H -5.929858 -4.782082 -0.950239
H -3.474249 -2.497557 -3.719650
H -3.120206 5.432883 -3.476446
H -5.349398 -4.112531 -3.300393


