%chk=000247212.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247212

0 1
S 0.847785 0.613188 0.658091
O 1.422213 1.399513 -0.425404
O 1.015621 1.078323 2.024794
O -4.827680 -0.061339 -0.642705
N 1.449426 -1.004970 0.626846
C 1.580729 -1.648798 -0.706235
C 2.566836 -1.291637 1.564770
C 2.674625 -1.081835 -1.623757
C 3.802821 -0.380083 1.467730
C 4.073300 -1.119101 -0.994987
C 4.261169 -0.013233 0.051667
C -0.827086 0.382925 0.315725
C -1.661321 -0.223084 1.258558
C -1.354432 0.832086 -0.907207
C -3.021074 -0.404985 0.997064
C -2.700143 0.665305 -1.197768
C -3.526354 0.042909 -0.233088
C -5.787833 -0.664695 0.261981
H 0.591632 -1.580767 -1.215166
H 1.761653 -2.736302 -0.538383
H 2.874148 -2.352686 1.429819
H 2.144875 -1.212870 2.597143
H 2.426057 -0.030069 -1.897761
H 2.675919 -1.648541 -2.573560
H 4.633554 -0.874132 2.009064
H 3.605146 0.559930 2.029297
H 4.828331 -0.990244 -1.795738
H 4.273580 -2.111378 -0.551037
H 5.327622 0.281753 0.089749
H 3.717644 0.900589 -0.284824
H -1.252283 -0.559105 2.218225
H -0.694540 1.323840 -1.634882
H -3.658170 -0.876082 1.737057
H -3.133255 1.004799 -2.136030
H -5.519186 -1.706036 0.460518
H -6.715030 -0.601178 -0.323734
H -5.864000 -0.076713 1.181269


%chk=000247212-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247212

0 1
S 0.847778 0.696510 0.735956
O 1.429744 1.699217 -0.427035
O 0.970875 1.104691 2.310535
O -4.978555 -0.089976 -0.688734
N 1.521891 -1.040199 0.656402
C 1.622613 -1.600311 -0.719542
C 2.653977 -1.269925 1.598075
C 2.764038 -1.117166 -1.647948
C 3.931557 -0.396042 1.472452
C 4.185548 -1.165638 -1.033642
C 4.414706 -0.063736 0.033733
C -0.954667 0.395975 0.310131
C -1.779674 -0.202957 1.273732
C -1.429538 0.841208 -0.938072
C -3.146447 -0.386782 0.972958
C -2.790872 0.656895 -1.236616
C -3.648103 0.040912 -0.285994
C -5.927397 -0.694457 0.253879
H 0.645034 -1.439137 -1.214754
H 1.713117 -2.694270 -0.557201
H 2.902382 -2.338641 1.442730
H 2.256155 -1.169191 2.623058
H 2.554810 -0.079209 -1.968187
H 2.724997 -1.753947 -2.556275
H 4.730173 -0.934600 2.022521
H 3.759006 0.551823 2.016215
H 4.914516 -1.019675 -1.854782
H 4.394545 -2.171867 -0.612158
H 5.493964 0.178235 0.088587
H 3.906429 0.856228 -0.313644
H -1.369698 -0.507928 2.241526
H -0.747519 1.336936 -1.636468
H -3.800265 -0.851641 1.715759
H -3.214779 0.985419 -2.189686
H -5.643481 -1.736738 0.495451
H -6.893635 -0.684950 -0.270309
H -6.000927 -0.099771 1.184448


