%chk=000277026.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277026

0 1
O 2.747623 -0.923949 -0.346869
O 3.252416 -0.183659 1.766021
N -1.515502 0.058127 -0.141071
N 4.009827 0.924902 -0.152287
C -0.237125 -0.620606 -0.512903
C 0.532106 -1.252651 0.671525
C -0.522004 -1.689742 -1.590557
C 1.815696 -1.934343 0.206520
C 0.794421 -2.282828 -2.102969
C 1.624567 -2.897248 -0.968209
C -1.280800 1.358709 0.568798
C -2.473999 -0.814885 0.609228
C -0.875059 2.428722 -0.459869
C -3.909727 -0.347460 0.309763
C -0.697106 3.798287 0.206747
C -4.941831 -1.246519 1.001264
C 3.349557 -0.073123 0.559028
C -0.301192 4.869516 -0.807381
C -6.369587 -0.787591 0.712506
C 5.003144 1.763929 0.550261
H 0.427113 0.166741 -0.968796
H -0.097929 -1.992991 1.198028
H 0.776090 -0.475667 1.425876
H -1.176039 -2.484910 -1.186557
H -1.088952 -1.229753 -2.423160
H 2.346490 -2.415452 1.058991
H 1.391415 -1.491092 -2.600282
H 0.590245 -3.047650 -2.874924
H 2.616144 -3.203184 -1.357870
H 1.136154 -3.818095 -0.593698
H -2.224015 1.670369 1.069324
H -0.511843 1.279545 1.367283
H -2.353134 -1.866947 0.266917
H -2.289259 -0.816656 1.704226
H -1.641953 2.482547 -1.257679
H 0.060776 2.128442 -0.971394
H -4.043309 0.704455 0.627665
H -4.073172 -0.341112 -0.786229
H 0.072620 3.734271 1.001060
H -1.634751 4.096037 0.715634
H -4.766698 -1.252560 2.094907
H -4.813802 -2.294909 0.667571
H 0.645658 4.625039 -1.302010
H -0.178850 5.845550 -0.325324
H -1.059563 4.981787 -1.590762
H -6.544022 0.234822 1.066698
H -7.102213 -1.436043 1.205305
H -6.587386 -0.801711 -0.361729
H 4.114153 0.829510 -1.159407
H 4.939514 2.796851 0.166769
H 6.032799 1.392757 0.418932
H 4.786791 1.792621 1.637187


%chk=000277026-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277026

0 1
O 2.799196 -0.896000 -0.325611
O 3.433728 -0.490398 1.917526
N -1.492541 0.063314 -0.141775
N 4.338958 0.713858 0.109653
C -0.231704 -0.617034 -0.558049
C 0.527444 -1.320408 0.606784
C -0.459549 -1.608721 -1.725048
C 1.848115 -1.964455 0.141060
C 0.881567 -2.209226 -2.214427
C 1.651470 -2.898986 -1.062904
C -1.269694 1.405307 0.456211
C -2.465779 -0.775591 0.600838
C -1.076257 2.511973 -0.604522
C -3.931471 -0.362013 0.339428
C -0.808603 3.899918 0.021340
C -4.940470 -1.204712 1.153048
C 3.523459 -0.236701 0.686620
C -0.614801 5.005739 -1.039059
C -6.406217 -0.785226 0.908989
C 5.234455 1.556149 0.904702
H 0.432975 0.180382 -0.945996
H -0.105141 -2.130292 1.023528
H 0.738436 -0.615123 1.431169
H -1.129708 -2.430800 -1.398242
H -0.976023 -1.077339 -2.545557
H 2.337879 -2.482228 0.986735
H 1.512869 -1.402295 -2.634796
H 0.699556 -2.935043 -3.030004
H 2.636610 -3.261593 -1.410113
H 1.081531 -3.782672 -0.710206
H -2.152358 1.662593 1.072384
H -0.394625 1.410151 1.153020
H -2.343860 -1.826168 0.275250
H -2.279137 -0.765438 1.704917
H -1.980761 2.547539 -1.242696
H -0.232930 2.244485 -1.273269
H -4.070085 0.709905 0.588030
H -4.136411 -0.459279 -0.744685
H 0.090822 3.844186 0.668841
H -1.653287 4.171125 0.687805
H -4.705133 -1.115221 2.233851
H -4.814678 -2.277029 0.896680
H 0.244234 4.775357 -1.697346
H -0.428841 5.990202 -0.571187
H -1.511296 5.098999 -1.680427
H -6.565950 0.273045 1.189701
H -7.108931 -1.401613 1.499593
H -6.676536 -0.892020 -0.158479
H 4.317565 0.792602 -0.907046
H 5.017058 2.629804 0.753009
H 6.296062 1.367915 0.656651
H 5.073282 1.309275 1.966182


