%chk=000290542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290542

0 1
O 2.679964 3.528816 0.679710
O -4.033101 -0.554477 -1.358343
O -3.727105 -1.482096 1.411614
N 0.859736 3.727640 -0.709348
C 1.768626 1.539836 -0.474680
C 0.418860 1.405054 -1.227864
C 1.981001 0.632041 0.749819
C 0.710639 0.504960 1.606340
C -0.056875 2.870310 -1.495550
C -0.663449 0.636446 -0.514204
C -0.534429 0.219733 0.822208
C 1.864937 3.015115 -0.060177
C 2.559017 -0.706917 0.335650
C -1.831257 0.328290 -1.232094
C -1.591124 -0.460061 1.450128
C -2.876059 -0.357937 -0.612054
C 3.913432 -0.963343 0.609880
C 1.797727 -1.686007 -0.316192
C -2.763185 -0.739501 0.744861
C 4.491871 -2.179715 0.240634
C 2.378905 -2.903542 -0.683662
C 3.725724 -3.154189 -0.407234
C -4.335030 -1.955968 -1.607728
C -5.025461 -0.832234 1.504862
H 2.601770 1.347632 -1.199635
H 0.616790 0.897639 -2.204414
H 2.749564 1.149658 1.399414
H 0.561633 1.453341 2.171543
H 0.874020 -0.277493 2.378239
H 0.013137 3.120417 -2.574431
H -1.110715 3.027792 -1.182744
H 0.674292 4.709228 -0.574867
H -1.943541 0.618022 -2.276582
H -1.513918 -0.780273 2.489279
H 4.520384 -0.211166 1.113011
H 0.746026 -1.507208 -0.536409
H 5.541671 -2.368829 0.458625
H 1.777143 -3.658963 -1.186077
H 4.176024 -4.102054 -0.693306
H -3.577512 -2.374684 -2.275357
H -5.311958 -1.898692 -2.098990
H -4.387275 -2.513382 -0.665557
H -5.651196 -1.626764 1.925019
H -5.378540 -0.517433 0.516084
H -4.949064 0.017858 2.188277


%chk=000290542-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290542

0 1
O 2.085735 3.517553 1.343372
O -4.027232 -0.530326 -1.479582
O -3.932802 -1.356254 1.339858
N 0.621546 3.602243 -0.509029
C 1.778472 1.569621 -0.219108
C 0.565022 1.308243 -1.156908
C 2.004374 0.539981 0.919764
C 0.699671 0.385495 1.735227
C 0.174447 2.755321 -1.628815
C -0.602566 0.593234 -0.470927
C -0.541896 0.159877 0.881213
C 1.538906 2.995992 0.331424
C 2.607459 -0.760044 0.373491
C -1.772995 0.330685 -1.226039
C -1.673456 -0.477513 1.448588
C -2.887434 -0.319542 -0.665528
C 3.973295 -0.758978 -0.020717
C 1.873750 -1.965668 0.236031
C -2.848881 -0.700452 0.707738
C 4.585951 -1.917476 -0.544016
C 2.484057 -3.130099 -0.286623
C 3.839951 -3.111903 -0.682528
C -4.376841 -1.955206 -1.689419
C -5.169597 -0.545256 1.433439
H 2.699865 1.621385 -0.834221
H 0.872571 0.712714 -2.035907
H 2.754939 1.006646 1.589385
H 0.569155 1.313338 2.327657
H 0.804119 -0.435409 2.468805
H 0.703229 3.021431 -2.567162
H -0.911440 2.854324 -1.798262
H 0.337941 4.574321 -0.382796
H -1.833853 0.611924 -2.284537
H -1.659887 -0.804157 2.494744
H 4.565398 0.158098 0.099633
H 0.821775 -2.002343 0.536178
H 5.642720 -1.893352 -0.834025
H 1.898567 -4.051923 -0.382050
H 4.311887 -4.015226 -1.085245
H -3.566977 -2.466732 -2.243711
H -5.296683 -1.945426 -2.293896
H -4.550376 -2.466146 -0.725247
H -5.918169 -1.205041 1.897984
H -5.506319 -0.219139 0.432731
H -4.995299 0.338083 2.076734


