%chk=000118017.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118017

0 1
O 0.540054 0.629508 -0.786987
O -0.601536 -2.694322 -0.278193
N 1.198592 -1.297028 0.322044
N 2.473410 0.806687 0.485763
C -0.548527 -0.332680 -1.024727
C -1.835172 0.206307 -0.479774
C -0.042909 -1.636280 -0.288652
C 1.474028 -0.023055 0.041395
C -2.923198 -0.663341 -0.307648
C -1.966850 1.567478 -0.174515
C -4.138595 -0.165810 0.166879
C -3.185797 2.057252 0.303028
C -4.272142 1.193360 0.472061
C 3.704171 0.209746 1.078922
C 4.789420 0.157302 0.125993
C 5.697339 0.106134 -0.664143
H -0.568598 -0.463350 -2.126781
H -2.815069 -1.728337 -0.531197
H -1.116438 2.236796 -0.307768
H -4.983004 -0.840640 0.302447
H -3.287847 3.114400 0.542847
H 2.587749 1.703038 0.004802
H -5.221183 1.577014 0.842709
H 3.979300 0.839956 1.966055
H 3.478652 -0.821106 1.477062
H 6.479249 0.056872 -1.340721


%chk=000118017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118017

0 1
O 0.504861 0.578777 -0.930599
O -0.696633 -2.721623 -0.083284
N 1.201594 -1.312332 0.284293
N 2.601322 0.627005 0.092814
C -0.634056 -0.393237 -1.013554
C -1.914670 0.203363 -0.450200
C -0.081731 -1.641549 -0.218710
C 1.469918 -0.077907 -0.143048
C -3.039917 -0.640865 -0.265229
C -2.013719 1.582046 -0.143799
C -4.249754 -0.104790 0.226891
C -3.227725 2.111805 0.349992
C -4.349574 1.272323 0.534858
C 3.719949 0.058783 0.875864
C 5.020367 0.248244 0.208910
C 6.119068 0.419519 -0.321821
H -0.741241 -0.659420 -2.080694
H -2.955894 -1.711040 -0.482560
H -1.145990 2.231478 -0.292721
H -5.112381 -0.764195 0.373174
H -3.296401 3.179704 0.586442
H 2.687249 1.562009 -0.309545
H -5.290392 1.685335 0.915621
H 3.749046 0.521320 1.881945
H 3.493584 -1.013766 1.015227
H 7.078219 0.554914 -0.789367


