%chk=000257066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257066

0 1
O -2.828792 -2.084368 -0.924388
O -2.039410 2.881817 0.425302
N -2.274448 0.129313 -0.518959
N 0.197931 2.353406 0.756750
N -4.398456 -0.764249 0.115638
N -0.474256 4.249089 -0.549116
C 0.090247 -0.177999 0.408662
C -0.223008 -1.453704 1.233200
C -0.845598 -0.066969 -0.833065
C -0.143589 1.040366 1.356455
C 1.554096 -0.219667 -0.028451
C -0.051130 -2.762196 0.449491
C 2.565015 0.034782 0.916207
C 1.932593 -0.538238 -1.341298
C -0.187600 -3.978004 1.363237
C 3.912168 -0.003868 0.552248
C 3.282438 -0.575672 -1.705977
C 4.277089 -0.303930 -0.763906
C -3.128128 -0.984028 -0.477128
C -0.853162 3.130353 0.224721
H -1.264027 -1.400570 1.611517
H 0.426741 -1.478886 2.129624
H -0.528722 0.793938 -1.465852
H -0.741318 -0.991921 -1.455978
H 0.480136 0.934819 2.275753
H -1.202559 1.055283 1.709414
H -0.823310 -2.818544 -0.353367
H 0.932099 -2.783673 -0.057558
H -2.510455 1.002655 -0.023982
H 1.117951 2.387514 0.312917
H 2.301683 0.254445 1.951054
H 1.184436 -0.779258 -2.096549
H -0.086614 -4.907876 0.791303
H 0.574840 -3.988617 2.148644
H -1.170390 -4.005429 1.848991
H 4.680736 0.194708 1.297896
H 3.556418 -0.824245 -2.730753
H 5.326507 -0.333691 -1.048919
H -5.096057 -1.473728 -0.076971
H -4.776921 0.168839 0.176854
H -1.209792 4.921665 -0.739720
H 0.439018 4.662636 -0.444239


%chk=000257066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257066

0 1
O -2.954412 -2.137768 -0.992296
O -2.154279 2.786663 0.284316
N -2.273586 0.036933 -0.416333
N 0.115883 2.327017 0.658010
N -4.526719 -0.583802 -0.244966
N -0.554158 4.363140 -0.315667
C 0.116166 -0.225090 0.396741
C -0.185072 -1.479452 1.285164
C -0.878425 -0.158522 -0.810161
C -0.113704 1.029572 1.311274
C 1.585965 -0.242735 -0.083628
C 0.032086 -2.854166 0.612486
C 2.640154 -0.191632 0.872769
C 1.952351 -0.321408 -1.453964
C -0.162395 -4.012113 1.615934
C 3.995843 -0.210420 0.481783
C 3.309802 -0.340781 -1.851812
C 4.340002 -0.281844 -0.888308
C -3.223341 -0.961669 -0.579140
C -0.922866 3.131790 0.216359
H -1.239708 -1.410343 1.621074
H 0.442731 -1.425155 2.199990
H -0.582193 0.676489 -1.475058
H -0.830077 -1.094771 -1.391826
H 0.543969 0.964276 2.197802
H -1.155071 1.021236 1.674510
H -0.691068 -2.972757 -0.215059
H 1.051298 -2.905593 0.181466
H -2.530965 0.998228 -0.134639
H 1.083410 2.580420 0.450822
H 2.403874 -0.155752 1.943319
H 1.181809 -0.382151 -2.228048
H -0.019204 -4.992615 1.125970
H 0.556758 -3.943461 2.455239
H -1.183712 -3.996788 2.040929
H 4.782191 -0.176582 1.244737
H 3.559581 -0.407851 -2.917038
H 5.391260 -0.299529 -1.196673
H -5.252640 -1.286104 -0.352408
H -4.772226 0.354831 0.062764
H -1.302142 4.953218 -0.670218
H 0.397230 4.723341 -0.296509


