%chk=000272006.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272006

0 1
O -0.801747 1.474340 1.882259
O -5.558345 -0.885360 0.463989
N -2.090103 -0.745595 -0.630314
N 1.947848 0.746478 -0.425600
N -2.596476 0.075387 1.542323
C -0.854914 -0.063625 -0.094183
C 0.322036 -0.992228 0.261983
C -0.416857 0.974281 -1.145006
C 1.554828 -0.178922 0.689372
C 0.843393 1.728623 -0.695230
C -3.133060 -0.797690 0.461988
C -1.353229 0.637793 1.202886
C -1.891641 -2.064098 -1.279088
C 3.212138 1.482006 -0.081170
C -4.417901 -0.262857 -0.087022
C 4.383215 0.529509 -0.024707
C -4.791505 0.689924 -0.997061
C -6.234415 0.685588 -1.036840
C -6.653502 -0.269373 -0.148746
C 5.270711 0.574221 1.060227
C 4.607386 -0.381597 -1.068632
C 6.375573 -0.281995 1.095539
C 5.710405 -1.236720 -1.026540
C 6.598030 -1.187555 0.054173
H 0.594665 -1.603912 -0.622805
H 0.041894 -1.698670 1.063835
H -1.236078 1.689220 -1.349540
H -0.221190 0.452218 -2.104471
H 1.345554 0.359585 1.642390
H 2.405125 -0.869841 0.881734
H 1.173418 2.408488 -1.509200
H 0.604694 2.361691 0.191935
H -3.299371 -1.831989 0.878569
H -3.226016 0.489184 2.220701
H -1.572133 -2.875929 -0.608273
H -1.142617 -1.958736 -2.083654
H -2.841223 -2.360030 -1.760832
H 3.127751 2.063881 0.864140
H 3.406212 2.226597 -0.889780
H -4.146736 1.317731 -1.584199
H -6.836311 1.322265 -1.656328
H -7.590586 -0.653562 0.186862
H 5.104416 1.273110 1.877178
H 3.905911 -0.421124 -1.903107
H 7.063376 -0.242426 1.938174
H 5.880523 -1.942498 -1.837407
H 7.458154 -1.852288 0.083574


%chk=000272006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272006

0 1
O -0.912523 1.913358 1.796630
O -5.461969 -1.296932 0.585884
N -2.110155 -0.384806 -0.680095
N 2.043100 0.826022 -0.328922
N -2.676948 0.411541 1.391527
C -0.876363 0.267646 -0.125280
C 0.231033 -0.741341 0.329541
C -0.273217 1.250196 -1.159040
C 1.523591 -0.028029 0.771392
C 1.057241 1.878655 -0.696490
C -3.084313 -0.618491 0.415406
C -1.451058 0.991872 1.121605
C -1.975249 -1.498723 -1.627911
C 3.368170 1.408277 -0.002984
C -4.505055 -0.475762 -0.059722
C 4.486069 0.371094 0.052183
C -5.139463 0.320750 -0.997953
C -6.550652 -0.003243 -0.950512
C -6.708888 -0.980342 0.017759
C 5.503790 0.462327 1.033042
C 4.551677 -0.673077 -0.905589
C 6.572725 -0.463461 1.055092
C 5.615385 -1.601719 -0.884449
C 6.632579 -1.499093 0.094803
H 0.476919 -1.395169 -0.529158
H -0.141345 -1.382228 1.152650
H -1.009993 2.043953 -1.378363
H -0.091953 0.688486 -2.096215
H 1.332087 0.573703 1.692703
H 2.292359 -0.783088 1.015980
H 1.481922 2.473682 -1.527681
H 0.859276 2.569193 0.156048
H -2.986562 -1.634633 0.878108
H -3.269223 0.703062 2.169050
H -1.613183 -2.447442 -1.166417
H -1.277118 -1.219409 -2.435012
H -2.957933 -1.699781 -2.090758
H 3.348703 1.978915 0.960551
H 3.599925 2.145941 -0.798364
H -4.644585 1.042422 -1.643670
H -7.341781 0.432306 -1.557621
H -7.558828 -1.532503 0.408596
H 5.457859 1.259558 1.785860
H 3.750461 -0.746487 -1.649707
H 7.352024 -0.380114 1.821415
H 5.654189 -2.404249 -1.630462
H 7.458570 -2.219336 0.110645


