%chk=000187110.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187110

0 1
O 0.557446 1.229828 -0.392372
O -5.873124 -2.524968 0.678454
O 2.262792 1.731030 -1.790175
O 0.705141 -1.675133 -1.465048
O -0.249506 -1.893009 0.577476
C -1.683658 2.059359 -0.428275
C -2.134963 0.594804 -0.275114
C -1.606658 2.763544 0.941137
C -3.625490 0.466212 0.054603
C -0.330923 2.121550 -1.153433
C -4.019114 -1.004442 0.229824
C -1.570174 4.283935 0.820802
C -5.479743 -1.143767 0.663022
C 1.841776 1.096419 -0.852074
C 2.581082 0.122550 0.006054
C 2.055364 -1.128301 0.361895
C 3.855654 0.497371 0.455432
C 2.796184 -1.995101 1.177025
C 4.593140 -0.370864 1.264914
C 4.063029 -1.613179 1.627830
C 0.707674 -1.586320 -0.092282
C -0.548345 -2.061333 -2.091125
H -2.421213 2.601858 -1.073532
H -1.523556 0.098631 0.511851
H -1.906332 0.027486 -1.205896
H -2.475265 2.461792 1.560555
H -0.711232 2.401638 1.487452
H -4.235715 0.930122 -0.744112
H -3.854350 1.032991 0.979818
H -0.373443 1.742158 -2.187803
H 0.119910 3.128537 -1.144532
H -3.863030 -1.562930 -0.714414
H -3.350617 -1.491477 0.968601
H -0.694131 4.628848 0.259541
H -2.460897 4.674787 0.316332
H -1.523900 4.754176 1.810437
H -6.182837 -0.703841 -0.069220
H -5.665221 -0.709237 1.660860
H -5.300871 -3.038478 1.280291
H 4.270314 1.465528 0.162924
H 2.380714 -2.963970 1.462057
H 5.584600 -0.077482 1.612305
H 4.638304 -2.287898 2.263162
H -0.269452 -2.146283 -3.146784
H -1.290408 -1.262975 -1.920454
H -0.896754 -3.013167 -1.679208


%chk=000187110-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187110

0 1
O 0.479045 1.055953 -0.518821
O -6.485771 -2.311040 0.612050
O 2.280474 2.039100 -1.632752
O 0.916131 -1.594625 -1.537464
O 0.205868 -2.422458 0.522449
C -1.787957 1.976535 -0.457317
C -2.436873 0.565654 -0.396796
C -1.589639 2.601317 0.951290
C -3.850441 0.515725 0.226820
C -0.479078 1.929970 -1.261646
C -4.482166 -0.890577 0.106692
C -0.991322 4.025540 0.943522
C -5.867618 -0.983310 0.770322
C 1.828576 1.182042 -0.836056
C 2.663563 0.242653 -0.019936
C 2.230454 -1.052372 0.383320
C 3.915487 0.729731 0.429077
C 3.022076 -1.801967 1.287322
C 4.713133 -0.036335 1.304596
C 4.255610 -1.297396 1.751183
C 1.004252 -1.728671 -0.151585
C -0.233184 -2.281415 -2.173125
H -2.465858 2.644427 -1.035850
H -1.765545 -0.115259 0.162800
H -2.501676 0.167619 -1.432995
H -2.572433 2.632515 1.458587
H -0.944629 1.928184 1.548900
H -4.506633 1.259785 -0.272305
H -3.803818 0.803615 1.296049
H -0.629911 1.478344 -2.260640
H -0.015209 2.922567 -1.393407
H -4.583099 -1.170593 -0.960703
H -3.800555 -1.635381 0.570772
H 0.049508 4.034858 0.572872
H -1.585193 4.707427 0.304856
H -0.979162 4.449043 1.964376
H -6.579947 -0.294540 0.284433
H -5.796416 -0.707668 1.845661
H -5.888252 -2.988073 1.019869
H 4.239838 1.719398 0.092016
H 2.665669 -2.786706 1.606058
H 5.677234 0.353835 1.647075
H 4.860549 -1.889860 2.445528
H -0.107231 -2.097858 -3.249217
H -1.181485 -1.858125 -1.802126
H -0.204165 -3.360611 -1.946955


