%chk=000268990.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268990

0 1
O -6.011073 0.065920 -1.851293
O 4.654005 -1.821022 -1.085671
O -6.232130 -1.873208 1.787884
O 6.878714 -0.293445 2.041209
N -4.635166 -0.707954 -0.158614
N 4.964158 0.151289 0.085863
C -0.087672 2.756423 -0.786730
C -1.277568 1.845768 -0.635383
C 1.220734 2.052539 -0.542372
C -1.433609 1.077800 0.529305
C 2.104132 2.520938 0.440266
C -2.540359 0.243369 0.705748
C 3.334396 1.894166 0.668578
C -3.516554 0.177701 -0.325487
C 3.683528 0.767970 -0.122100
C -2.249335 1.775557 -1.639849
C 1.573489 0.932310 -1.306917
C -3.363418 0.948352 -1.487673
C 2.794544 0.292843 -1.100430
C -2.663578 -0.560506 1.960008
C 4.245763 2.428467 1.726549
C -5.810819 -0.676954 -0.908268
C 5.341256 -1.109492 -0.377211
C -6.857940 -1.711625 -0.504624
C 6.750288 -1.543887 0.018071
C -7.134412 -1.822461 0.978561
C 7.119691 -1.336524 1.470285
C -8.574294 -1.890247 1.374158
C 7.815335 -2.477455 2.139811
H -0.063719 3.209603 -1.802698
H -0.211469 3.618550 -0.094587
H -0.669409 1.130334 1.305662
H 1.830252 3.387187 1.040851
H -2.146376 2.364471 -2.549593
H 0.886353 0.551678 -2.062776
H -4.120540 0.909529 -2.278966
H 3.053893 -0.587480 -1.699776
H -1.958580 -0.229980 2.735515
H -2.449642 -1.623537 1.774104
H -3.668011 -0.491313 2.405203
H 3.738232 3.140175 2.391988
H 5.099900 2.962540 1.284957
H 4.645854 1.632921 2.374457
H -4.602841 -1.322551 0.674463
H 5.594336 0.635335 0.750338
H -7.783258 -1.478395 -1.080320
H -6.538352 -2.707694 -0.888639
H 6.857996 -2.610627 -0.286432
H 7.481658 -0.999743 -0.622780
H -9.119468 -2.685695 0.848476
H -9.095983 -0.945009 1.157409
H -8.684833 -2.075141 2.455209
H 8.703788 -2.812911 1.587995
H 7.151175 -3.350026 2.241104
H 8.143138 -2.206354 3.156766


%chk=000268990-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268990

0 1
O -6.205849 0.124434 -2.081144
O 4.887672 -1.954550 -1.193004
O -6.332293 -1.834000 1.740184
O 7.054933 -0.083299 2.008460
N -4.906865 -0.477298 -0.202303
N 4.997630 -0.027301 0.169472
C -0.061939 2.680985 -0.708757
C -1.327537 1.830509 -0.607499
C 1.248831 1.935055 -0.467300
C -1.540317 0.963911 0.494619
C 2.213972 2.437825 0.438708
C -2.717488 0.199780 0.640485
C 3.455444 1.798949 0.662255
C -3.728310 0.309413 -0.368472
C 3.736042 0.598157 -0.061134
C -2.341466 1.913468 -1.589735
C 1.553587 0.739328 -1.163360
C -3.533283 1.166749 -1.480835
C 2.778785 0.073323 -0.969742
C -2.896318 -0.719059 1.837992
C 4.457140 2.383998 1.644644
C -6.023551 -0.533232 -1.012109
C 5.487774 -1.200227 -0.369131
C -7.107426 -1.550666 -0.561961
C 6.935771 -1.561788 0.063688
C -7.309581 -1.793832 0.933625
C 7.399064 -1.178053 1.469020
C -8.734306 -1.995831 1.409912
C 8.300317 -2.161805 2.188136
H -0.037299 3.149485 -1.713232
H -0.127505 3.519339 0.014445
H -0.757685 0.874986 1.258075
H 1.995622 3.360200 0.992902
H -2.203907 2.571765 -2.456510
H 0.819322 0.318463 -1.860139
H -4.313486 1.236287 -2.240938
H 3.008454 -0.848085 -1.508145
H -2.016348 -0.668092 2.499890
H -3.018260 -1.778010 1.535664
H -3.783607 -0.452590 2.445077
H 4.051282 3.294966 2.114647
H 5.409099 2.664452 1.151959
H 4.711577 1.677087 2.458185
H -4.978963 -1.047449 0.657371
H 5.622437 0.406922 0.869959
H -8.049963 -1.241334 -1.041816
H -6.833028 -2.528179 -1.014332
H 7.057189 -2.643348 -0.109174
H 7.617446 -1.053282 -0.652005
H -9.259868 -2.735420 0.777679
H -9.293703 -1.044454 1.316205
H -8.748115 -2.320749 2.461312
H 9.132279 -2.484835 1.535003
H 7.724742 -3.073505 2.441874
H 8.698057 -1.717066 3.112932


