%chk=000116998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116998

0 1
O -2.369388 2.377908 -0.725870
O 0.884269 3.206573 1.067156
O -3.512081 -1.069054 0.771508
O -1.306944 -2.920852 0.043864
O 3.106629 1.497396 -0.849167
O 3.124807 -1.828419 0.507400
N -0.178432 1.601602 -0.298887
N -1.875242 0.062239 -0.536108
N 1.678166 -0.056190 0.220511
N 0.900979 -2.373075 0.242743
C 0.368340 0.327624 -0.080020
C -0.663429 -0.618721 -0.194785
C -1.627654 1.449508 -0.515040
C -0.482096 -2.029126 0.014908
C 0.491943 2.920467 -0.263113
C 1.979263 -1.467569 0.330935
C -3.220682 -0.572955 -0.513609
C 2.799060 0.920473 0.401528
H -0.217423 3.686759 -0.651521
H 1.456238 2.896881 -0.831741
H -3.228352 -1.389932 -1.268860
H -3.994954 0.208100 -0.699441
H 3.676972 0.388737 0.834088
H 2.466595 1.783641 1.033697
H 1.130100 -3.373158 0.367260
H 0.112086 3.400178 1.647863
H -3.026390 -1.923868 0.942279
H 3.574921 0.865933 -1.444377


%chk=000116998-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116998

0 1
O -2.405626 2.421386 -0.594084
O 0.898703 3.347755 1.047845
O -3.578159 -1.357127 0.632152
O -1.355043 -2.950848 0.140225
O 3.188946 1.439190 -0.952421
O 3.185298 -1.854076 0.485091
N -0.176790 1.574920 -0.233719
N -1.883677 0.086433 -0.341481
N 1.673047 -0.063535 0.232552
N 0.903684 -2.328908 0.289926
C 0.358819 0.307125 -0.029100
C -0.685722 -0.620286 -0.100005
C -1.620304 1.458317 -0.408394
C -0.477266 -2.023159 0.108503
C 0.468086 2.894983 -0.269375
C 1.998275 -1.453506 0.341988
C -3.230521 -0.531282 -0.487189
C 2.790646 0.909383 0.340981
H -0.278625 3.573272 -0.719123
H 1.383321 2.847683 -0.876732
H -3.238324 -1.102276 -1.437643
H -3.946458 0.302883 -0.532153
H 3.611607 0.372443 0.842597
H 2.454532 1.773550 0.932113
H 1.133490 -3.320697 0.409790
H 0.121225 3.666642 1.571689
H -3.023125 -2.193951 0.579420
H 3.777262 0.794787 -1.420251


