%chk=000279543.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279543

0 1
O 2.769015 0.488016 -1.449095
O 2.730991 -2.250630 0.130122
O 2.828729 0.837551 1.870575
O 5.454166 -1.076612 -0.446326
O -5.155307 1.919085 -0.030384
O -3.932903 -2.249367 2.053272
N 0.509379 0.443064 -0.917197
N -0.915934 2.217058 -1.267202
N -1.079516 -1.081503 0.280583
N -3.330926 -0.080138 0.504974
N -3.780577 2.212210 -0.052891
N -2.904890 -2.370875 1.098836
C 2.147116 -0.971862 0.370772
C 1.735005 -0.393803 -1.014242
C 3.289007 -0.042753 0.863629
C 3.763135 0.717025 -0.393855
C 5.095994 0.203332 -0.962548
C -0.719740 0.074985 -0.360842
C 0.321631 1.762621 -1.465653
C -1.599290 1.197486 -0.579547
C -2.930319 1.079546 -0.093373
C -2.402460 -1.100889 0.651836
H 1.317102 -1.046540 1.105710
H 1.618131 -1.162272 -1.816135
H 4.111917 -0.613977 1.367887
H 3.769168 1.818108 -0.250789
H 5.945141 0.842047 -0.647183
H 5.047785 0.160458 -2.069239
H 2.083680 -2.965159 0.330970
H 2.087723 1.403398 1.556045
H 1.136137 2.269651 -1.972503
H 4.768157 -1.752673 -0.681216
H -3.673418 2.874129 -0.836894
H -2.201253 -2.954824 1.576729
H -5.326466 1.514976 0.890204
H -4.746711 -1.939571 1.521272


%chk=000279543-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279543

0 1
O 2.821325 0.263775 -1.598840
O 2.990344 -2.270670 0.001377
O 2.380782 0.975174 1.666883
O 5.482182 -1.141221 -0.388272
O -5.115074 1.926213 0.354635
O -4.141633 -2.153045 1.942102
N 0.525513 0.420390 -0.899605
N -0.855761 2.228041 -1.226784
N -1.054777 -1.099674 0.276233
N -3.278085 -0.047953 0.580198
N -3.781369 2.107918 -0.141679
N -2.867613 -2.225950 1.263142
C 2.164189 -1.083395 0.263761
C 1.695706 -0.486976 -1.090573
C 3.102385 0.022662 0.821843
C 3.724826 0.670456 -0.446634
C 5.157738 0.220997 -0.787941
C -0.710291 0.069940 -0.338524
C 0.370586 1.721957 -1.439464
C -1.538373 1.206832 -0.542776
C -2.869976 1.108197 -0.040915
C -2.360286 -1.079407 0.692449
H 1.333335 -1.314125 0.950226
H 1.435895 -1.259024 -1.836736
H 3.872747 -0.417300 1.470583
H 3.681464 1.773634 -0.378611
H 5.875590 0.867758 -0.251862
H 5.300226 0.367638 -1.879689
H 2.420089 -3.051578 -0.204248
H 1.649367 1.399320 1.147097
H 1.181380 2.210962 -1.971384
H 4.687750 -1.738762 -0.498365
H -3.637373 3.007867 -0.594031
H -2.267122 -2.948997 1.657024
H -5.073615 0.982147 0.704841
H -4.472668 -1.252500 1.630840


