%chk=000222210.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222210

0 1
O 3.709056 -0.240946 -0.623160
O 0.436479 0.377208 0.775863
O -2.834884 -1.043260 0.488540
O 1.511394 -1.594148 0.498626
O -1.479377 -0.125735 -1.081579
O 4.361154 -0.306122 1.555497
C 2.493930 0.529944 -0.394007
C 2.769762 1.791751 0.395550
C 1.970326 0.756792 -1.805673
C 1.495233 -0.403565 0.335657
C -0.746411 -0.299921 1.278016
C -1.320729 0.620002 2.334075
C -1.676575 -0.440772 0.065330
C 4.544028 -0.634219 0.410151
C -3.886539 -1.291099 -0.494942
C -4.887363 -0.161845 -0.476203
C 5.625442 -1.471679 -0.174749
C -4.321745 1.213408 -0.602895
C -6.194453 -0.413464 -0.379029
H 3.520696 2.420205 -0.098263
H 3.149385 1.569493 1.408096
H 1.853189 2.387865 0.518214
H 2.068082 -0.152483 -2.418687
H 2.527063 1.549221 -2.320125
H 0.903652 1.037384 -1.798985
H -0.469434 -1.310486 1.670517
H -1.400462 1.655010 1.971763
H -0.678099 0.646220 3.225853
H -2.322927 0.287936 2.645065
H -3.434377 -1.417136 -1.498974
H -4.296912 -2.253944 -0.135612
H 5.650799 -1.421378 -1.275611
H 5.477522 -2.530715 0.098497
H 6.611231 -1.167756 0.209092
H -3.516400 1.256172 -1.354666
H -3.887422 1.543495 0.352255
H -5.077257 1.955194 -0.891234
H -6.615252 -1.401155 -0.273243
H -6.949206 0.358829 -0.396219


%chk=000222210-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222210

0 1
O 3.835093 -0.267036 -0.663085
O 0.617589 0.630855 0.789026
O -2.670803 -0.930069 0.397977
O 1.231946 -1.387666 -0.201910
O -1.412587 0.349793 -1.107055
O 3.674750 -0.816003 1.601565
C 2.633403 0.634988 -0.556253
C 3.000099 1.895875 0.241724
C 2.272077 0.944590 -2.023779
C 1.467111 -0.186070 0.037455
C -0.643073 -0.005254 1.235979
C -1.234636 0.901981 2.321509
C -1.579002 -0.154791 0.022850
C 4.239153 -0.949040 0.491518
C -3.725076 -1.192936 -0.646269
C -4.971599 -0.383168 -0.357334
C 5.401502 -1.863627 0.182946
C -4.803922 1.123148 -0.325915
C -6.165377 -1.007814 -0.179733
H 3.887735 2.364470 -0.218308
H 3.217445 1.653124 1.292864
H 2.164251 2.613572 0.213973
H 2.125732 0.007178 -2.584594
H 3.087299 1.522103 -2.491297
H 1.338244 1.530675 -2.065910
H -0.422190 -1.015263 1.624865
H -1.433205 1.911888 1.923666
H -0.520919 0.988394 3.157248
H -2.176129 0.468175 2.697508
H -3.287689 -0.929041 -1.627570
H -3.911330 -2.276037 -0.583297
H 6.089468 -1.397848 -0.540266
H 5.014525 -2.793763 -0.271994
H 5.930668 -2.119877 1.112675
H -4.305534 1.486589 -1.244569
H -4.164297 1.428799 0.524516
H -5.774474 1.636006 -0.222092
H -6.252993 -2.100826 -0.191308
H -7.090656 -0.441775 -0.024524


