%chk=000229996.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229996

0 1
O 0.209138 0.067644 -0.344474
O -3.226049 0.935887 -0.391686
O -4.019333 -1.021238 0.408203
C 2.536069 -0.229003 -0.377941
C 3.783144 0.011697 0.492877
C 2.666751 -1.439480 -1.323608
C 5.013369 0.379900 -0.346485
C 1.292423 -0.364711 0.520784
C 6.227674 0.685931 0.541885
C 3.009576 -2.755631 -0.631449
C 7.457884 1.044105 -0.288981
C -1.097500 -0.063086 0.258133
C -2.042750 0.256427 -0.901163
C -4.176441 0.168049 0.249594
C -5.326208 1.021566 0.683505
C -5.486744 2.327912 -0.012599
C -6.130647 0.565665 1.646770
H 2.371047 0.677037 -1.021839
H 3.576644 0.825413 1.216019
H 3.998707 -0.887128 1.101767
H 1.708445 -1.549480 -1.874573
H 3.433106 -1.216097 -2.091530
H 4.787089 1.254063 -0.986839
H 5.257101 -0.446961 -1.041844
H 1.324395 0.303843 1.397095
H 1.110917 -1.401669 0.848050
H 6.452998 -0.186749 1.185502
H 5.989226 1.517925 1.233020
H 3.035793 -3.581658 -1.351195
H 3.990741 -2.712767 -0.144583
H 2.270582 -3.014280 0.135482
H 7.745510 0.225314 -0.958277
H 7.280823 1.928441 -0.911725
H 8.319320 1.261710 0.352167
H -1.241703 -1.085789 0.648332
H -1.196036 0.669926 1.078743
H -1.614825 1.019197 -1.581436
H -2.349920 -0.641516 -1.462583
H -4.536193 2.888109 -0.034104
H -5.787696 2.183063 -1.061662
H -6.239807 2.969874 0.461636
H -6.982978 1.117860 2.019268
H -5.994841 -0.398214 2.127045


%chk=000229996-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229996

0 1
O 0.231064 0.413211 -0.630785
O -3.428855 0.992529 -0.438476
O -3.801187 -1.206656 0.255705
C 2.654732 0.114996 -0.542051
C 3.907357 0.300306 0.358457
C 2.576124 -1.270720 -1.244923
C 5.253240 0.133261 -0.382300
C 1.387498 0.413800 0.278647
C 6.473651 0.460930 0.508121
C 2.601740 -2.494805 -0.301113
C 7.820132 0.280386 -0.225582
C -1.032327 0.641236 0.070096
C -2.119483 0.575773 -1.008749
C -4.191189 -0.015696 0.174091
C -5.491899 0.533775 0.683793
C -5.785428 2.008833 0.506112
C -6.342513 -0.344056 1.284401
H 2.698322 0.882731 -1.344012
H 3.875254 1.316484 0.806272
H 3.869402 -0.411314 1.209459
H 1.645188 -1.290755 -1.841616
H 3.413304 -1.351765 -1.965371
H 5.265799 0.792070 -1.276183
H 5.351074 -0.904567 -0.759488
H 1.472776 1.410175 0.768570
H 1.236071 -0.347520 1.076713
H 6.452091 -0.186815 1.408706
H 6.387508 1.504329 0.875018
H 2.517846 -3.431094 -0.882668
H 3.540280 -2.548350 0.281270
H 1.759091 -2.478235 0.414428
H 7.943639 -0.761784 -0.576131
H 7.880150 0.940338 -1.111706
H 8.676063 0.519170 0.432225
H -1.202754 -0.138069 0.842714
H -1.037312 1.640042 0.559574
H -1.914521 1.302473 -1.809430
H -2.199464 -0.445330 -1.417673
H -5.016726 2.628823 1.001346
H -5.770890 2.289549 -0.562102
H -6.772508 2.263757 0.927585
H -7.310711 -0.019082 1.680029
H -6.072832 -1.401262 1.382330


