%chk=000199278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199278

0 1
O 4.642933 2.484703 0.440398
O 3.989037 -0.852139 -1.115344
O -5.266777 0.293642 1.451141
N 1.730751 0.765187 0.568812
N 1.056242 -0.282028 0.506444
C 3.197852 0.608911 0.619734
C 3.817177 1.821271 -0.134564
C 3.747754 -0.724327 0.059375
C -3.177671 -0.218550 0.474289
C -0.386761 -0.168160 0.491212
C -2.455574 -1.049115 -0.394840
C -2.492278 0.633060 1.355998
C -1.060888 -1.033611 -0.389596
C -1.097637 0.670186 1.365087
C 3.357907 2.042474 -1.530293
C 3.942170 -1.801287 1.073142
C -4.676927 -0.205244 0.516339
C -5.413591 -0.813962 -0.640659
H 3.499649 0.713755 1.703859
H -2.976544 -1.720821 -1.078594
H -3.067023 1.269119 2.038922
H -0.494916 -1.684174 -1.058020
H -0.566915 1.340852 2.041884
H 2.288350 2.299948 -1.573850
H 3.915278 2.854773 -2.019760
H 3.490126 1.127446 -2.141016
H 4.633787 -1.508862 1.874812
H 2.985342 -2.076842 1.548035
H 4.346231 -2.717154 0.611888
H -5.301186 -1.905990 -0.665915
H -5.074805 -0.417328 -1.606163
H -6.493993 -0.609035 -0.564354


%chk=000199278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199278

0 1
O 4.988217 2.181603 0.699639
O 3.790151 -0.775159 -1.303647
O -5.265944 1.020752 0.749507
N 1.744044 0.714478 0.720540
N 1.077245 -0.324018 0.313477
C 3.227894 0.503500 0.717453
C 3.937445 1.769320 0.149565
C 3.680842 -0.781403 -0.053038
C -3.183693 -0.086893 0.268275
C -0.354393 -0.165506 0.331927
C -2.487916 -1.205864 -0.261347
C -2.442035 0.991957 0.833005
C -1.080677 -1.246997 -0.226014
C -1.041244 0.961417 0.867870
C 3.325049 2.386559 -1.083573
C 3.959160 -1.999392 0.801240
C -4.688341 0.007126 0.258819
C -5.496010 -1.133187 -0.349243
H 3.530134 0.428763 1.779605
H -3.038696 -2.043441 -0.700114
H -3.004535 1.840141 1.237139
H -0.520601 -2.097323 -0.627784
H -0.460787 1.782133 1.299866
H 2.287778 2.703925 -0.866500
H 3.922043 3.243824 -1.428009
H 3.269737 1.611653 -1.872617
H 4.768546 -1.784286 1.524771
H 3.051942 -2.247285 1.384710
H 4.242865 -2.856875 0.172196
H -5.298235 -2.086485 0.175527
H -5.235641 -1.281006 -1.414056
H -6.567243 -0.895334 -0.270789


