%chk=000257399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257399

0 1
O 2.047744 -1.724110 0.279867
O 1.621014 3.023811 0.087686
O 4.779804 -0.311381 0.346518
N 3.449341 1.606963 0.218590
C -4.450472 -0.014744 -0.068492
C -2.926563 0.107411 0.008685
C -4.937819 -1.440969 0.251117
C -4.882117 0.354734 -1.502010
C -5.098006 0.951513 0.944312
C -2.085371 -1.010145 0.071376
C -2.334230 1.384237 -0.013825
C -0.109283 0.413220 0.109240
C -0.696699 -0.863666 0.123563
C -0.952449 1.540183 0.037317
C 1.337989 0.558088 0.165975
C 2.299038 -0.412909 0.242998
C 2.019407 1.894140 0.146366
C 3.700439 0.219326 0.280387
C 3.208891 -2.647786 0.365570
C 2.539961 -4.001872 0.386493
H -6.031224 -1.498694 0.217786
H -4.556757 -2.172917 -0.468463
H -4.626475 -1.755496 1.252947
H -4.419181 -0.310060 -2.239318
H -5.967181 0.280394 -1.622876
H -4.592016 1.378226 -1.761321
H -6.187091 0.842475 0.957293
H -4.733432 0.761867 1.959775
H -4.881647 1.998667 0.708639
H -2.501116 -2.016829 0.078139
H -2.964894 2.271861 -0.071927
H -0.068245 -1.755424 0.174932
H -0.525020 2.546730 0.020394
H 4.171941 2.320252 0.223664
H 3.844611 -2.476983 -0.520278
H 3.764735 -2.409669 1.288808
H 3.283161 -4.807689 0.451422
H 1.858096 -4.105057 1.243140
H 1.938914 -4.172396 -0.518489


%chk=000257399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257399

0 1
O 2.126628 -1.738326 0.335213
O 1.636015 3.072160 -0.084920
O 4.859788 -0.297694 0.319065
N 3.483557 1.623817 0.106727
C -4.506720 -0.000796 -0.082475
C -2.967104 0.122417 -0.028177
C -4.986511 -1.471407 0.018493
C -5.023845 0.590411 -1.429666
C -5.129761 0.800127 1.101510
C -2.105548 -0.997219 0.105848
C -2.349611 1.402038 -0.114521
C -0.091901 0.430114 0.065166
C -0.704774 -0.855363 0.152102
C -0.954709 1.561857 -0.069940
C 1.366729 0.583278 0.111160
C 2.355282 -0.390133 0.231094
C 2.086963 1.905072 0.029381
C 3.728907 0.248938 0.230379
C 3.268669 -2.708556 0.460305
C 2.632626 -4.089682 0.555425
H -6.090467 -1.504647 -0.028751
H -4.597167 -2.087149 -0.813343
H -4.678318 -1.937882 0.972436
H -4.607361 0.034013 -2.289279
H -6.127356 0.524294 -1.474648
H -4.742317 1.652147 -1.545220
H -6.233596 0.730545 1.068853
H -4.785243 0.399623 2.072516
H -4.855694 1.869302 1.059906
H -2.526509 -2.004667 0.175881
H -2.971103 2.299044 -0.220183
H -0.075626 -1.742078 0.256004
H -0.517278 2.561172 -0.139606
H 4.207862 2.341370 0.075333
H 3.919256 -2.600887 -0.424580
H 3.854442 -2.447966 1.358511
H 3.426197 -4.853724 0.644665
H 1.977889 -4.164785 1.440467
H 2.035507 -4.313476 -0.345134


