%chk=000294656.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294656

0 1
O -2.791176 -0.928759 0.788293
O 1.010657 0.763911 1.912594
O -4.388022 -0.607646 -0.787618
O 0.448955 2.837307 1.080683
N -0.746055 0.919924 0.516275
N -1.396278 0.961050 -2.831162
C -1.743414 1.626863 -0.310993
C -3.178883 1.299016 0.150559
C -2.852499 -2.384533 0.615079
C -3.555186 -0.146182 -0.049722
C -1.802470 -2.771193 -0.385121
C 3.352110 1.317118 1.586541
C 2.204703 1.327757 2.554114
C 0.261897 1.637572 1.151507
C -2.059654 -2.621396 -1.756335
C -0.561447 -3.260282 0.045564
C 4.291862 0.277201 1.616110
C 3.484925 2.354024 0.650668
C -1.554322 1.246678 -1.725321
C -1.077484 -2.958727 -2.690265
C 0.415468 -3.603068 -0.893915
C 5.365357 0.282253 0.720544
C 4.557510 2.352745 -0.243910
C 0.159638 -3.451250 -2.260423
C 5.499744 1.319071 -0.208313
H -1.574043 2.748918 -0.217373
H -3.907899 1.936496 -0.401679
H -3.291689 1.567938 1.226870
H -0.861465 -0.092818 0.662510
H -3.875173 -2.673653 0.305381
H -2.651000 -2.738282 1.642768
H 1.968691 2.342900 2.927889
H 2.326970 0.625330 3.400533
H -3.024814 -2.232397 -2.091301
H -0.352911 -3.372027 1.108191
H 4.186805 -0.537023 2.330934
H 2.739083 3.154465 0.618058
H -1.274160 -2.829367 -3.754592
H 1.379588 -3.983151 -0.559617
H 6.095945 -0.524350 0.745159
H 4.657781 3.157201 -0.971223
H 0.924764 -3.711619 -2.990481
H 6.335891 1.320586 -0.905659


%chk=000294656-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294656

0 1
O -2.461637 -0.995515 0.558745
O 1.180928 1.107244 2.080878
O -4.553377 -0.565564 -0.390667
O 0.496749 3.125425 1.057225
N -0.608358 1.089418 0.686626
N -1.116432 0.924860 -2.775805
C -1.593186 1.650564 -0.236926
C -3.061450 1.314879 0.160279
C -2.732515 -2.491578 0.516894
C -3.461201 -0.154488 0.053480
C -2.022309 -3.129079 -0.651719
C 3.574393 1.778546 1.832803
C 2.343176 1.832358 2.710100
C 0.369316 1.885124 1.246865
C -2.612607 -3.116469 -1.942351
C -0.755755 -3.740857 -0.473557
C 4.535359 0.750040 2.005068
C 3.781259 2.757755 0.826090
C -1.325097 1.244599 -1.646063
C -1.940643 -3.700528 -3.037264
C -0.085009 -4.329859 -1.568248
C 5.682984 0.694833 1.183022
C 4.927147 2.702143 0.002895
C -0.676584 -4.309062 -2.852371
C 5.880494 1.671647 0.179303
H -1.468574 2.750117 -0.183525
H -3.758635 1.882533 -0.477686
H -3.207337 1.644624 1.206174
H -0.660390 0.089389 0.896917
H -3.826997 -2.617511 0.466665
H -2.342547 -2.840376 1.485828
H 2.023100 2.870235 2.904911
H 2.485369 1.286464 3.655738
H -3.590565 -2.641462 -2.083349
H -0.294269 -3.755114 0.521885
H 4.382385 -0.009117 2.782357
H 3.033093 3.546114 0.686376
H -2.398414 -3.679891 -4.032030
H 0.893497 -4.800301 -1.422362
H 6.420593 -0.103016 1.324759
H 5.077566 3.460254 -0.773658
H -0.155632 -4.761321 -3.703553
H 6.770411 1.630546 -0.458951


