%chk=000290360.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290360

0 1
O 1.663472 3.125580 0.413766
N 2.208278 -0.290220 -0.721850
N -0.847246 2.292331 -0.612480
C 1.565705 -1.605156 -0.388168
C 3.685194 -0.562510 -0.708353
C 2.572262 -2.435159 0.438522
C 3.943721 -1.768524 0.222640
C 1.820326 0.793307 0.232589
C 1.681755 2.086732 -0.592822
C 0.384667 2.159107 -1.427790
C -1.526164 1.104363 -0.205378
C -1.512243 -0.069167 -0.984877
C -2.330271 1.152303 0.956819
C -3.103248 -1.113653 0.527876
C -2.297561 -1.161275 -0.618762
C -3.110784 0.054940 1.308392
C -3.951920 -2.280188 0.919968
H 1.346387 -2.103168 -1.356746
H 0.596779 -1.475317 0.130580
H 4.269338 0.326728 -0.412550
H 3.970671 -0.806134 -1.753952
H 2.578904 -3.488187 0.115617
H 2.298930 -2.438452 1.506670
H 4.379286 -1.443258 1.181590
H 4.666271 -2.468291 -0.226399
H 2.550490 0.961609 1.053832
H 0.858943 0.560685 0.740306
H 2.568228 2.244754 -1.246184
H 0.333362 1.261764 -2.091229
H 0.414377 3.042582 -2.104823
H -0.689912 2.951023 0.163506
H 1.716098 4.006025 -0.000686
H -0.889377 -0.120613 -1.877849
H -2.350794 2.048677 1.571554
H -2.284070 -2.058073 -1.236137
H -3.733621 0.104017 2.200462
H -3.790473 -2.562280 1.969067
H -5.019684 -2.044573 0.804293
H -3.751476 -3.171125 0.312089


%chk=000290360-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290360

0 1
O 1.560130 2.895220 0.270922
N 2.816128 -0.523043 -0.547930
N -0.605650 1.119220 0.164739
C 2.886842 -1.815570 0.191896
C 4.168109 -0.405527 -1.175000
C 4.307923 -1.857649 0.835995
C 5.196170 -1.075945 -0.185223
C 2.435542 0.649589 0.282815
C 1.669822 1.679303 -0.572822
C 0.275029 1.175578 -0.998338
C -1.872372 0.528657 0.156794
C -2.365230 -0.202781 -0.962456
C -2.714144 0.637388 1.305903
C -4.482898 -0.700371 0.218039
C -3.643129 -0.803305 -0.917185
C -3.985117 0.036327 1.327644
C -5.862431 -1.337614 0.253274
H 2.781454 -2.642661 -0.537538
H 2.060936 -1.896792 0.917588
H 4.404635 0.652617 -1.383821
H 4.164037 -0.947056 -2.139713
H 4.663006 -2.889449 1.004733
H 4.294601 -1.342066 1.813631
H 5.821728 -0.321950 0.323427
H 5.875590 -1.753510 -0.732239
H 3.305467 1.167145 0.745133
H 1.772442 0.313994 1.100083
H 2.257895 1.899035 -1.488605
H 0.421917 0.167775 -1.433095
H -0.139043 1.831354 -1.801993
H -0.383323 1.790101 0.904355
H 1.206340 3.639946 -0.278857
H -1.756107 -0.304872 -1.866322
H -2.356659 1.192755 2.182986
H -3.994380 -1.363200 -1.793568
H -4.606256 0.138510 2.227202
H -5.987750 -1.991165 1.137643
H -6.664353 -0.574892 0.298259
H -6.042304 -1.953890 -0.645256


