%chk=000233943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233943

0 1
O -0.987986 -0.872125 -1.634546
N 0.639200 1.134718 0.792144
N -2.730047 -0.159020 -0.386501
C -0.642692 -0.999298 0.762304
C -0.262005 0.244714 1.583559
C 0.629391 -1.786026 0.404045
C 1.795537 -0.914078 0.026297
C 1.805851 0.485253 0.267170
C -1.421562 -0.652373 -0.514790
C 0.875192 2.424773 1.500262
C 2.899935 -1.510459 -0.591304
C 2.930227 1.241356 -0.121647
C -3.475495 0.203847 -1.625548
C -3.419946 0.087542 0.900666
C 4.013340 -0.753273 -0.967566
C 4.020067 0.623077 -0.735801
C -3.415948 1.705394 -1.901039
C -3.902490 -1.214991 1.541442
H -1.302874 -1.653806 1.392837
H -1.181749 0.827641 1.842310
H 0.199152 -0.079889 2.542906
H 0.402892 -2.471536 -0.446415
H 0.918587 -2.431466 1.258013
H 1.355329 3.135746 0.803357
H 1.508205 2.336817 2.396420
H -0.090869 2.868249 1.788437
H 2.892178 -2.581774 -0.789497
H 2.950324 2.317267 0.034703
H -3.021720 -0.354147 -2.483649
H -4.526432 -0.141573 -1.529033
H -2.734450 0.633898 1.597462
H -4.284762 0.768000 0.729654
H 4.862053 -1.234256 -1.445400
H 4.878255 1.221852 -1.035888
H -3.881705 2.295710 -1.106674
H -2.373209 2.044510 -1.990930
H -3.919016 1.950649 -2.842778
H -4.569240 -1.769662 0.868744
H -3.064276 -1.884184 1.780921
H -4.453042 -1.021877 2.468051


%chk=000233943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233943

0 1
O -0.836156 -0.506996 -1.522263
N 0.813475 1.161663 0.887393
N -2.724203 -0.132925 -0.228324
C -0.600473 -0.897454 0.892420
C -0.136233 0.368898 1.674159
C 0.647762 -1.745034 0.545498
C 1.855863 -0.922971 0.106805
C 1.902995 0.497255 0.289595
C -1.387002 -0.508699 -0.376359
C 0.832399 2.614279 1.059392
C 2.949764 -1.569065 -0.505284
C 3.053619 1.213012 -0.154035
C -3.453352 0.305170 -1.446592
C -3.507778 -0.213780 1.024000
C 4.091584 -0.860433 -0.942708
C 4.131462 0.540182 -0.765080
C -3.327177 1.824799 -1.683696
C -4.273881 -1.548479 1.177673
H -1.250040 -1.487658 1.566878
H -0.997004 1.015102 1.924288
H 0.313300 0.025686 2.636087
H 0.390388 -2.459302 -0.257157
H 0.915849 -2.344829 1.439587
H 1.040958 3.116819 0.096230
H 1.591089 2.961516 1.796743
H -0.159469 2.952481 1.405060
H 2.896989 -2.655543 -0.655963
H 3.113590 2.296833 -0.017381
H -3.025870 -0.238174 -2.306110
H -4.514651 0.011970 -1.339367
H -2.849040 -0.060586 1.894408
H -4.226046 0.628847 1.027897
H 4.925312 -1.388639 -1.417123
H 5.004005 1.114558 -1.098024
H -3.726249 2.403288 -0.829565
H -2.266801 2.093477 -1.827407
H -3.886450 2.122322 -2.589964
H -4.953699 -1.716234 0.323232
H -3.574362 -2.402162 1.225284
H -4.880268 -1.543992 2.102470


