%chk=000213061.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213061

0 1
O 0.317877 0.575663 -0.825368
O -1.665756 -1.158744 0.178899
O -1.025476 2.842983 -1.415377
O -3.767745 -0.230597 0.139974
N -3.300141 -2.250172 -0.926777
C -0.591151 1.069532 0.206845
C 0.167044 2.052602 1.114533
C -1.195878 -0.079668 1.033564
C -1.636047 1.769456 -0.697884
C -0.689468 2.647337 2.224585
C 1.457826 -0.130566 -0.450320
C 1.371705 -1.505664 -0.198266
C 2.682057 0.551997 -0.466794
C -3.004339 -1.114574 -0.189708
C 2.552158 -2.210246 0.046078
C 3.849333 -0.175316 -0.222789
C 3.786259 -1.549146 0.038037
H 0.555084 2.873852 0.468515
H 1.061444 1.560151 1.544183
H -0.434907 -0.599697 1.646869
H -2.025182 0.277365 1.675244
H -2.435791 2.254363 -0.107060
H -2.079919 1.056106 -1.415832
H -1.597156 3.121911 1.828073
H -0.994850 1.902677 2.966951
H -0.135948 3.428773 2.762246
H -0.285677 2.485780 -1.964144
H 0.400875 -2.002088 -0.215727
H 2.710823 1.616867 -0.682347
H 2.511339 -3.281420 0.241092
H 4.813846 0.331537 -0.236042
H 4.700753 -2.106484 0.230433
H -2.561909 -2.853864 -1.255829
H -4.181182 -2.292805 -1.419355


%chk=000213061-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213061

0 1
O 0.445371 0.640896 -0.900047
O -1.741301 -1.136222 0.022291
O -1.034418 2.843235 -1.555158
O -3.907506 -0.439887 0.672069
N -3.554311 -2.141680 -0.906969
C -0.573300 1.085849 0.134975
C 0.114833 2.081114 1.105360
C -1.150288 -0.111027 0.911962
C -1.628388 1.760830 -0.770976
C -0.791775 2.678062 2.206431
C 1.587260 -0.097827 -0.498448
C 1.504453 -1.502253 -0.331491
C 2.831379 0.566790 -0.379375
C -3.155734 -1.175602 -0.013387
C 2.673106 -2.235314 -0.025852
C 3.995105 -0.177415 -0.080809
C 3.919491 -1.578152 0.102989
H 0.511449 2.902632 0.480433
H 0.981633 1.575751 1.574735
H -0.355085 -0.630878 1.471451
H -1.934306 0.236686 1.607460
H -2.426600 2.218883 -0.166402
H -2.072320 0.994302 -1.436182
H -1.668457 3.194721 1.777447
H -1.156733 1.914603 2.916929
H -0.223699 3.424418 2.790257
H -0.251813 2.446536 -2.021105
H 0.536857 -1.997794 -0.461740
H 2.875720 1.649479 -0.537212
H 2.611053 -3.322150 0.101193
H 4.959153 0.336332 0.005854
H 4.823244 -2.152051 0.335031
H -2.865621 -2.675637 -1.431432
H -4.548554 -2.299327 -1.043780


