%chk=000192633.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192633

0 1
O -3.454905 1.739202 -0.382021
N 3.271409 0.563795 0.485508
N -1.485828 1.255780 0.662721
C 1.314336 1.264158 -0.453693
C 1.320080 -0.177655 -0.447282
C 0.216558 2.126517 -0.958084
C 2.560572 -0.595433 0.149017
C 2.509156 1.689732 0.115437
C -0.807909 2.466210 0.143675
C 0.409553 -1.158406 -0.889492
C 2.883836 -1.961111 0.312590
C 4.598385 0.602247 1.105915
C 0.731903 -2.492339 -0.725963
C 1.960173 -2.888530 -0.127832
C -3.297308 -0.398370 0.758604
C -2.791556 0.942660 0.262290
C -4.665649 -0.724169 0.144647
C -5.224736 -2.038828 0.677193
H -0.299748 1.629653 -1.807998
H 0.622611 3.070586 -1.376841
H 2.860540 2.691904 0.277275
H -0.304276 2.973291 0.996095
H -1.575982 3.170837 -0.258870
H -0.524118 -0.852730 -1.357920
H 3.823545 -2.258066 0.764489
H -0.867768 0.546091 1.050192
H 5.347438 0.105196 0.461387
H 4.929821 1.641257 1.272409
H 4.588730 0.086649 2.084190
H 0.046307 -3.267002 -1.062277
H -2.575533 -1.205640 0.524108
H -3.375775 -0.375942 1.865673
H 2.165900 -3.953204 -0.023879
H -4.578653 -0.760866 -0.960147
H -5.370073 0.109207 0.351359
H -4.563018 -2.883500 0.455488
H -5.369371 -2.009190 1.763162
H -6.199348 -2.260691 0.225774


%chk=000192633-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192633

0 1
O -3.676335 2.000990 -0.009928
N 3.326447 0.536131 0.434546
N -1.550043 1.260049 0.591667
C 1.337937 1.272738 -0.463840
C 1.333322 -0.183057 -0.447091
C 0.229017 2.187535 -0.931496
C 2.588623 -0.611505 0.120602
C 2.565740 1.662485 0.076170
C -0.848206 2.474521 0.154268
C 0.401797 -1.170899 -0.871290
C 2.921771 -1.975748 0.280450
C 4.672595 0.545256 1.007918
C 0.730106 -2.531983 -0.715465
C 1.974979 -2.930505 -0.142544
C -3.471305 -0.240816 0.981766
C -2.922590 1.098488 0.473064
C -4.521775 -0.841381 0.017239
C -5.202447 -2.096794 0.600332
H -0.275510 1.757698 -1.817714
H 0.651347 3.161837 -1.244729
H 2.962798 2.665982 0.226282
H -0.366122 2.963639 1.023992
H -1.623913 3.153679 -0.241149
H -0.551742 -0.877951 -1.325581
H 3.878682 -2.288779 0.712254
H -0.988776 0.485637 0.953122
H 5.398831 0.060551 0.328838
H 4.992857 1.586139 1.173377
H 4.692609 0.017242 1.979283
H 0.023167 -3.302135 -1.043685
H -2.652113 -0.965160 1.161661
H -3.956679 -0.052067 1.960999
H 2.199909 -3.997491 -0.034921
H -4.035141 -1.089510 -0.946839
H -5.270703 -0.059006 -0.202498
H -4.464706 -2.892648 0.817771
H -5.728489 -1.859441 1.544650
H -5.946640 -2.510421 -0.104583


