%chk=000179195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179195

0 1
O -1.839681 1.416435 -0.336362
O -1.483626 -0.754608 0.399830
O 3.051799 0.917196 -0.248400
N -3.580966 0.028769 -0.304508
C -4.394333 -1.222062 -0.053842
C -5.835175 -0.898509 -0.477133
C -3.816394 -2.361408 -0.902306
C -4.325984 -1.564600 1.439804
C -2.232839 0.092060 -0.028363
C -0.515527 1.840420 -0.299511
C 0.590060 0.991870 -0.232611
C 1.848369 1.602880 -0.248464
C -0.403943 3.238632 -0.384431
C 2.014888 2.996647 -0.336074
C 0.875424 3.799124 -0.406974
C 3.110896 -0.421557 0.165822
C 2.489959 -0.882209 1.330843
C 3.948511 -1.225011 -0.619395
C 2.719147 -2.206813 1.713214
C 4.165890 -2.541437 -0.208240
C 3.552325 -3.033154 0.950510
H -6.267897 -0.078891 0.107962
H -5.907454 -0.632269 -1.538131
H -6.483222 -1.771284 -0.325802
H -2.772102 -2.576341 -0.623741
H -3.819716 -2.123443 -1.971456
H -4.382890 -3.287955 -0.766124
H -4.697398 -0.748907 2.069094
H -4.915048 -2.457559 1.671820
H -3.290364 -1.769835 1.754733
H -4.052794 0.859020 -0.661952
H 0.472170 -0.093005 -0.173308
H -1.296926 3.853976 -0.433373
H 3.015039 3.421251 -0.348767
H 0.984854 4.882709 -0.476042
H 1.847716 -0.230104 1.919911
H 4.411445 -0.818732 -1.515532
H 2.243513 -2.595081 2.613857
H 4.814436 -3.189434 -0.797182
H 3.723637 -4.062281 1.258621


%chk=000179195-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179195

0 1
O -1.863030 1.441702 -0.592864
O -1.575279 -0.469547 0.811688
O 3.056594 0.906455 -0.391066
N -3.552683 -0.047766 -0.406688
C -4.375065 -1.226439 0.012696
C -5.731275 -1.086687 -0.719107
C -3.667233 -2.538644 -0.415101
C -4.586970 -1.198465 1.548848
C -2.279481 0.205357 0.023592
C -0.541701 1.929438 -0.394451
C 0.581521 1.079597 -0.464325
C 1.860644 1.654673 -0.294080
C -0.414535 3.321666 -0.206155
C 2.024107 3.045966 -0.108535
C 0.880396 3.871536 -0.076667
C 3.129930 -0.459500 -0.008876
C 2.337971 -1.033945 1.013376
C 4.135069 -1.207875 -0.661617
C 2.562049 -2.383301 1.369097
C 4.348242 -2.552507 -0.290458
C 3.561364 -3.148109 0.723920
H -6.247318 -0.151608 -0.430825
H -5.596634 -1.096153 -1.817055
H -6.388307 -1.931589 -0.452039
H -2.680472 -2.622082 0.069933
H -3.526121 -2.566919 -1.510621
H -4.278872 -3.409711 -0.118776
H -5.104391 -0.271338 1.854800
H -5.202234 -2.061617 1.860405
H -3.618314 -1.250836 2.073180
H -3.958539 0.633042 -1.051417
H 0.459647 0.008487 -0.632267
H -1.312296 3.944123 -0.163208
H 3.032734 3.452314 0.005517
H 0.997313 4.951148 0.063834
H 1.564700 -0.452452 1.523088
H 4.731745 -0.724861 -1.441249
H 1.948957 -2.832289 2.158185
H 5.127565 -3.134057 -0.795282
H 3.726001 -4.192706 1.008568


