%chk=000257344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257344

0 1
O 1.684342 -2.485377 -1.283124
O 1.314919 2.240429 -1.566550
O 3.418133 0.233874 1.985888
N -0.411324 -0.200745 -1.222085
N 2.571252 -1.144691 0.337853
N 2.292385 1.259535 0.247078
C 1.065267 -0.162465 -1.425746
C -0.789197 -0.437672 0.211942
C 1.792892 -1.369005 -0.825380
C 1.535475 1.219745 -0.964604
C -1.045715 -1.198208 -2.131284
C 2.804162 0.129849 0.945490
C -2.245688 -0.086322 0.411820
C 3.244366 -2.309852 0.980554
C 2.618205 2.596279 0.823778
C -2.746339 1.143438 -0.041338
C -3.092843 -0.981822 1.080149
C -4.085959 1.473663 0.176375
C -4.431508 -0.643136 1.298921
C -4.929975 0.583030 0.848491
H 1.258515 -0.195682 -2.545091
H -0.178218 0.229246 0.864838
H -0.583952 -1.480132 0.544880
H -0.641896 -2.221609 -2.044727
H -0.926919 -0.859490 -3.174039
H -2.130539 -1.232203 -1.925753
H 2.739854 -3.248509 0.686051
H 3.212686 -2.211750 2.080862
H 4.300195 -2.365866 0.665478
H 3.582321 2.563904 1.362595
H 1.831712 2.906697 1.532283
H 2.683917 3.349484 0.016504
H -2.087617 1.831381 -0.574884
H -2.715279 -1.939664 1.431719
H -4.472967 2.427773 -0.178422
H -5.087008 -1.338116 1.821069
H -5.972354 0.843991 1.019610


%chk=000257344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257344

0 1
O 1.920190 -2.405765 -1.556220
O 1.087843 2.326868 -1.426002
O 3.430998 0.199736 2.006446
N -0.370910 -0.354418 -1.212546
N 2.589491 -1.137480 0.290352
N 2.259887 1.266456 0.291922
C 1.077756 -0.113297 -1.440229
C -0.798448 -0.519109 0.199759
C 1.923462 -1.299896 -0.947302
C 1.470182 1.260572 -0.881519
C -0.985842 -1.319375 -2.149344
C 2.785284 0.110485 0.929432
C -2.257093 -0.113417 0.403741
C 3.233079 -2.310270 0.933024
C 2.594329 2.565416 0.929316
C -2.757167 1.071514 -0.193799
C -3.111858 -0.885296 1.226668
C -4.090068 1.477214 0.033791
C -4.446264 -0.477722 1.459261
C -4.938770 0.705736 0.863765
H 1.216227 -0.056303 -2.534442
H -0.160267 0.133993 0.826624
H -0.651313 -1.563038 0.566858
H -0.634159 -2.364008 -1.998954
H -0.753709 -1.023774 -3.187000
H -2.080312 -1.286862 -2.014865
H 2.990498 -3.191064 0.321334
H 2.853611 -2.428956 1.960105
H 4.325158 -2.169861 0.978720
H 3.686966 2.704581 0.953661
H 2.216794 2.584800 1.963781
H 2.120849 3.355516 0.329519
H -2.095076 1.653395 -0.845401
H -2.736096 -1.808584 1.685772
H -4.467676 2.394107 -0.433003
H -5.099210 -1.083742 2.097555
H -5.973063 1.021853 1.040424


