%chk=000251671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251671

0 1
O 3.848159 0.704445 -0.315486
O 2.437737 -0.998904 -0.930679
N 1.657304 1.035758 -0.031603
N -0.124667 3.245865 -0.009082
C -1.660555 -0.730156 0.041298
C -2.540045 0.367375 0.104298
C -2.148876 -2.155613 0.050624
C -4.034161 0.194537 0.199335
C -0.278160 -0.504416 -0.018329
C -2.022446 1.670038 0.060397
C 0.243002 0.794038 -0.030024
C -0.643503 1.907177 -0.023877
C -2.194697 -2.715585 1.472301
C -4.680688 0.201130 -1.185803
C 2.601664 0.111368 -0.471207
C 5.007943 -0.118099 -0.665751
C 5.269077 -1.136798 0.422814
H -3.149479 -2.231442 -0.421344
H -1.486318 -2.786898 -0.579069
H -4.285811 -0.746546 0.730867
H -4.472643 1.000668 0.823273
H 0.406416 -1.359798 -0.061582
H -2.709966 2.514102 0.090023
H -1.199107 -2.710024 1.933556
H -2.558633 -3.748427 1.480706
H -2.851870 -2.122506 2.118685
H -4.498505 1.147982 -1.707849
H -5.764699 0.059887 -1.118888
H -4.278404 -0.598049 -1.820306
H 1.985425 1.910696 0.391275
H 0.526472 3.425328 -0.769034
H -0.851806 3.953982 -0.025344
H 4.823829 -0.583392 -1.650785
H 5.788422 0.662338 -0.733938
H 6.218684 -1.660747 0.264374
H 5.304445 -0.668717 1.414993
H 4.473360 -1.897698 0.452262


%chk=000251671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251671

0 1
O 3.883486 0.726086 -0.384667
O 2.532305 -1.129848 -0.946761
N 1.641256 0.949648 -0.236479
N -0.005108 3.143184 -0.067919
C -1.730145 -0.777407 -0.054127
C -2.570415 0.360562 0.134216
C -2.272158 -2.203446 -0.029248
C -4.084254 0.242470 0.281853
C -0.334461 -0.588704 -0.209365
C -1.986932 1.651610 0.112106
C 0.240498 0.700492 -0.188532
C -0.599586 1.848585 -0.065129
C -2.325199 -2.795506 1.405906
C -4.822696 0.256191 -1.084595
C 2.647180 0.060410 -0.556378
C 5.093638 -0.105698 -0.629043
C 5.471364 -0.909476 0.619047
H -3.282795 -2.247933 -0.476103
H -1.626496 -2.848703 -0.654253
H -4.351099 -0.681946 0.826299
H -4.459197 1.084066 0.895781
H 0.323071 -1.452569 -0.341913
H -2.636364 2.531711 0.215906
H -1.316690 -2.811826 1.856838
H -2.715825 -3.830138 1.394333
H -2.974717 -2.189788 2.064566
H -4.616756 1.194074 -1.631774
H -5.916558 0.170077 -0.945559
H -4.490756 -0.580990 -1.725272
H 1.940956 1.866122 0.112985
H 0.621216 3.371626 -0.843669
H -0.600703 3.917103 0.227272
H 4.895998 -0.772719 -1.486818
H 5.867167 0.633079 -0.894692
H 6.416609 -1.455957 0.441484
H 5.614342 -0.244243 1.488293
H 4.686725 -1.647300 0.856513


