%chk=000298799.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298799

0 1
O 0.624566 2.566602 0.870567
N 1.218145 -2.092122 -0.295181
N -0.058548 -2.257605 -0.305613
C 0.944791 0.289402 -0.004340
C 1.539157 1.664623 0.170998
C -0.459503 0.124987 -0.071180
C -1.289779 1.327895 -0.001668
C 1.771480 -0.841585 -0.118498
C -0.701121 2.509126 0.510675
C -0.937958 -1.204782 -0.171590
C 1.913754 2.293157 -1.162383
C -2.635464 1.405031 -0.400783
C 3.249671 -0.768710 -0.067835
C -2.361520 -1.604660 -0.109899
C -1.432210 3.688275 0.727094
C -3.369295 2.576425 -0.216842
C -2.776294 3.706345 0.366396
C 3.898703 -0.607751 1.165621
C 3.993053 -0.866047 -1.252815
C -2.967044 -2.226962 -1.211792
C -3.091333 -1.392534 1.071486
C 5.293033 -0.529231 1.206417
C 5.387547 -0.784524 -1.201653
C -4.307076 -2.617594 -1.135767
C -4.428347 -1.789853 1.138494
C 6.037501 -0.613063 0.024727
C -5.038268 -2.398358 0.035609
H 2.392360 1.666167 0.894315
H 2.217918 3.340293 -1.028711
H 2.748327 1.758240 -1.634463
H 1.074272 2.291481 -1.869727
H -3.117662 0.542586 -0.866668
H -0.938629 4.556230 1.158275
H -4.412383 2.613595 -0.525180
H -3.367888 4.608856 0.524352
H 3.319229 -0.559836 2.086739
H 3.484947 -1.020255 -2.204120
H -2.388114 -2.416853 -2.115394
H -2.613818 -0.921526 1.929904
H 5.800994 -0.408030 2.162385
H 5.968397 -0.862303 -2.119825
H -4.778444 -3.101522 -1.990014
H -4.995810 -1.628969 2.054012
H 7.124061 -0.551941 0.061069
H -6.080600 -2.707200 0.092705


%chk=000298799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298799

0 1
O 0.598385 2.541124 1.134628
N 1.251801 -1.875750 -0.910290
N -0.095405 -2.052425 -0.923551
C 0.945191 0.382246 -0.033781
C 1.507866 1.773828 0.233074
C -0.468397 0.243499 -0.154418
C -1.304164 1.454799 0.009009
C 1.779729 -0.728229 -0.340192
C -0.739125 2.567112 0.704490
C -0.953299 -1.076998 -0.451150
C 1.753418 2.548554 -1.078059
C -2.633501 1.594632 -0.478896
C 3.261968 -0.753380 -0.177463
C -2.348824 -1.565212 -0.267064
C -1.498420 3.714444 1.013757
C -3.387744 2.753046 -0.212591
C -2.830231 3.802830 0.560787
C 3.884969 -0.337848 1.030550
C 4.070033 -1.271467 -1.224220
C -2.901789 -2.484882 -1.197489
C -3.103423 -1.212095 0.884898
C 5.287350 -0.411558 1.175146
C 5.472041 -1.337509 -1.080904
C -4.194350 -3.014661 -0.997941
C -4.391058 -1.750584 1.087231
C 6.086955 -0.901888 0.116593
C -4.945304 -2.648113 0.143521
H 2.441232 1.727090 0.809011
H 2.109465 3.567803 -0.849571
H 2.527539 2.030920 -1.672406
H 0.836029 2.618353 -1.687806
H -3.078756 0.786666 -1.064772
H -1.024625 4.524232 1.576586
H -4.408117 2.837526 -0.599866
H -3.422439 4.696404 0.786035
H 3.271964 -0.003693 1.876125
H 3.581826 -1.630435 -2.135556
H -2.299751 -2.782771 -2.061188
H -2.678303 -0.525484 1.624608
H 5.753280 -0.098970 2.116163
H 6.083938 -1.733968 -1.898645
H -4.612361 -3.717094 -1.727510
H -4.958845 -1.476155 1.983203
H 7.175534 -0.956023 0.228731
H -5.947483 -3.062416 0.301084


