%chk=000245555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245555

0 1
O 1.371867 -1.554853 -0.243049
N 3.620384 0.023183 0.231165
C -1.468735 -1.832962 -0.020670
C -0.748437 -0.474483 -0.087402
C -1.445729 0.748475 -0.009614
C -2.950402 0.875111 0.198391
C 0.664698 -0.385023 -0.236314
C -2.501095 -1.918957 -1.169420
C -2.159310 -1.975600 1.354721
C -0.543393 -3.055089 -0.180847
C 1.352857 0.842412 -0.380140
C -0.757611 1.975522 -0.111340
C 0.615402 2.026859 -0.302784
C 2.828859 0.923326 -0.677586
C -3.601631 1.592968 -0.991892
C -3.249404 1.596980 1.520001
C 3.556623 0.488102 1.647817
C 5.037402 -0.072320 -0.229619
H -3.417725 -0.147853 0.266801
H -2.909772 -2.929852 -1.259875
H -3.350721 -1.243670 -1.018484
H -2.036786 -1.661396 -2.126680
H -2.986858 -1.268143 1.479419
H -2.571332 -2.980249 1.488395
H -1.445605 -1.797995 2.165551
H -1.110662 -3.989403 -0.169049
H 0.015810 -3.017621 -1.124315
H 0.198073 -3.109672 0.627049
H -1.318278 2.906205 -0.043509
H 1.115457 2.989909 -0.394913
H 2.995932 0.581414 -1.727239
H 3.175043 1.979664 -0.636086
H -3.283319 2.638620 -1.066068
H -4.692846 1.588709 -0.905411
H -3.336266 1.107121 -1.938300
H -2.739980 1.109379 2.359391
H -4.323182 1.598925 1.732909
H -2.917360 2.640823 1.503079
H 2.377290 -1.400704 -0.137720
H 2.498701 0.552912 1.958863
H 4.024211 1.466055 1.830857
H 4.043519 -0.258919 2.294096
H 5.580741 -0.776143 0.422049
H 5.585046 0.881634 -0.232724
H 5.062222 -0.489900 -1.249007


%chk=000245555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245555

0 1
O 1.548886 -1.435137 -0.170278
N 3.611379 0.042979 0.241691
C -1.435969 -1.846029 -0.025177
C -0.723489 -0.449751 -0.088135
C -1.471637 0.783728 -0.030826
C -2.997502 0.904900 0.192012
C 0.705873 -0.322419 -0.209631
C -2.465109 -1.966870 -1.200497
C -2.112778 -2.043916 1.371145
C -0.516592 -3.094604 -0.203759
C 1.351897 0.948821 -0.364527
C -0.805294 2.033990 -0.146370
C 0.583855 2.123556 -0.323709
C 2.846957 0.997443 -0.640826
C -3.701322 1.611489 -0.999024
C -3.310760 1.637928 1.526101
C 3.608774 0.466583 1.667081
C 4.980500 -0.221547 -0.264033
H -3.445547 -0.094054 0.275716
H -3.024926 -2.917034 -1.104786
H -3.196453 -1.148270 -1.256132
H -1.920340 -1.989925 -2.162557
H -2.845520 -1.265419 1.634428
H -2.631451 -3.021663 1.398062
H -1.336614 -2.050361 2.158741
H -1.170385 -3.989840 -0.219199
H 0.052953 -3.060373 -1.145847
H 0.210655 -3.201257 0.614259
H -1.393715 2.956336 -0.097137
H 1.070675 3.101083 -0.432080
H 3.047656 0.671715 -1.681778
H 3.230085 2.035518 -0.531402
H -3.355237 2.654392 -1.114938
H -4.796226 1.635543 -0.840284
H -3.499931 1.086940 -1.950971
H -2.838871 1.122879 2.382896
H -4.403321 1.671937 1.699166
H -2.937792 2.678009 1.515098
H 2.526520 -1.062346 0.020422
H 2.570071 0.644156 1.991168
H 4.194655 1.399187 1.824529
H 4.041187 -0.335052 2.290211
H 5.476993 -0.962661 0.385568
H 5.606233 0.698840 -0.288346
H 4.924675 -0.635925 -1.285550


