%chk=000227791.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227791

0 1
O -4.161986 -0.350418 1.648845
O -5.097681 -0.839543 -0.477049
O 0.503532 3.302146 1.071814
O -0.835449 2.547757 -0.449469
N 1.228468 -1.101555 -0.350656
N 0.141311 2.458228 0.266339
C -1.020974 -0.253946 -0.312153
C 0.442711 -0.039292 -0.180332
C -3.161840 -0.376059 0.686312
C -1.816557 -0.161829 0.863094
C 0.994102 1.256325 0.148067
C 3.204181 0.266264 0.176397
C -3.726143 -0.673648 -0.594115
C 2.603259 -0.974874 -0.190350
C -1.566043 -0.555885 -1.559298
C 2.354899 1.394104 0.343687
C -2.954681 -0.770885 -1.729044
C -5.414673 -0.624857 0.939060
C 4.622954 0.326218 0.351312
C 3.425100 -2.132220 -0.387906
C 5.387282 -0.796109 0.159859
C 4.781650 -2.035004 -0.214637
H -1.384964 0.058582 1.835161
H -0.916091 -0.630259 -2.432889
H 2.783871 2.365266 0.621311
H -3.378691 -0.997865 -2.703217
H -6.046739 0.270421 1.010592
H -5.828606 -1.560865 1.336211
H 5.075989 1.275918 0.637682
H 2.939390 -3.069043 -0.671053
H 6.469339 -0.764329 0.289758
H 5.424383 -2.905543 -0.359232


%chk=000227791-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227791

0 1
O -4.352029 0.184670 1.434757
O -5.120861 -1.165579 -0.392903
O 0.486743 3.157074 1.655777
O -0.694363 2.740793 -0.256213
N 1.266505 -0.996530 -0.563733
N 0.203410 2.435934 0.617844
C -1.020921 -0.281912 -0.259100
C 0.436189 -0.004915 -0.163364
C -3.274716 -0.138085 0.571127
C -1.936777 0.209672 0.723237
C 1.003224 1.208801 0.397003
C 3.238774 0.249694 0.283182
C -3.729899 -0.942170 -0.498496
C 2.634116 -0.883870 -0.390127
C -1.483607 -1.109435 -1.317464
C 2.368672 1.313263 0.660833
C -2.851634 -1.449686 -1.459886
C -5.568979 -0.302585 0.737864
C 4.655092 0.277429 0.492367
C 3.474713 -1.942735 -0.859115
C 5.449596 -0.776085 0.034753
C 4.855388 -1.886834 -0.648793
H -1.615753 0.810409 1.577942
H -0.749454 -1.487203 -2.033808
H 2.759679 2.228923 1.115909
H -3.204514 -2.079181 -2.280017
H -6.124077 0.561310 0.327752
H -6.165120 -0.910555 1.435362
H 5.104659 1.133627 1.008554
H 2.999602 -2.787336 -1.366671
H 6.532852 -0.757472 0.193515
H 5.494794 -2.702231 -1.003989


