%chk=000269120.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269120

0 1
O 2.136521 -0.816963 0.455927
O 1.093127 1.669017 -0.169328
N -3.250356 -0.115409 -0.017268
N -2.052295 1.816819 -0.356465
N -1.404941 -1.707567 0.383321
N 0.727695 -0.625690 0.230134
C -4.369351 -1.085013 0.118341
C -5.237228 -1.178704 -1.165978
C -5.391440 -0.679138 1.213764
C -6.353938 -0.099172 -1.016147
C -6.424377 0.250282 0.510818
C -1.902396 -0.451818 0.104702
C -3.278385 1.260468 -0.295617
C -1.174957 0.751903 -0.108097
C 0.273468 0.750651 -0.034871
C -0.073369 -1.737781 0.435062
C 2.910326 -0.728744 -0.861094
C 4.327290 -0.383209 -0.492741
C 4.619665 0.917870 -0.005032
C 5.370176 -1.332299 -0.625855
C 5.943607 1.259983 0.341848
C 6.697537 -0.985871 -0.284850
C 6.985119 0.310726 0.199811
H -3.874518 -2.043350 0.350897
H -5.685424 -2.188972 -1.198711
H -4.634485 -1.057282 -2.082298
H -4.905024 -0.213174 2.087811
H -5.888939 -1.602216 1.565469
H -7.320207 -0.478470 -1.391609
H -6.115599 0.799483 -1.613658
H -6.171567 1.312622 0.681464
H -7.438370 0.100737 0.920411
H -4.204961 1.806746 -0.446361
H 0.458182 -2.665220 0.660651
H 2.437743 0.065157 -1.462260
H 2.824396 -1.708949 -1.365549
H 3.801251 1.638969 0.103527
H 5.145005 -2.340294 -0.996023
H 6.166487 2.264060 0.719255
H 7.501530 -1.722154 -0.394038
H 8.013508 0.580375 0.466038


%chk=000269120-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269120

0 1
O 2.116792 -0.898167 0.412491
O 1.106680 1.677919 0.140631
N -3.270381 -0.057263 0.388734
N -2.052470 1.881095 0.188876
N -1.442303 -1.717631 0.468866
N 0.701742 -0.659388 0.297870
C -4.409132 -1.011303 0.461847
C -4.914522 -1.399774 -0.955443
C -5.660751 -0.385167 1.137412
C -5.860702 -0.239111 -1.351132
C -6.562287 0.172859 -0.017895
C -1.927307 -0.429656 0.366743
C -3.284467 1.341199 0.273705
C -1.187010 0.779321 0.244996
C 0.264403 0.748430 0.221880
C -0.111051 -1.774241 0.429886
C 2.816484 -0.661968 -0.927436
C 4.254200 -0.359318 -0.603519
C 4.578338 0.868824 0.031309
C 5.285416 -1.275735 -0.924010
C 5.921675 1.171333 0.337736
C 6.632024 -0.967602 -0.623518
C 6.951144 0.256197 0.008245
H -4.023497 -1.887105 1.010125
H -5.480756 -2.347078 -0.870474
H -4.086938 -1.565006 -1.665717
H -5.383443 0.381760 1.881252
H -6.190792 -1.183305 1.686273
H -6.581210 -0.533787 -2.133526
H -5.270876 0.604811 -1.755262
H -6.686487 1.268745 0.048742
H -7.574600 -0.264710 0.042720
H -4.207272 1.915564 0.267661
H 0.411728 -2.729751 0.516692
H 2.315889 0.194433 -1.408166
H 2.696640 -1.579259 -1.533075
H 3.769176 1.563951 0.283128
H 5.036601 -2.228408 -1.408036
H 6.168795 2.118902 0.829043
H 7.426582 -1.677888 -0.877682
H 7.994453 0.495687 0.243428


