%chk=000289060.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289060

0 1
O -0.518754 -0.818979 2.130010
O -2.133152 -1.992925 -2.059393
O -1.067038 1.646838 -0.448729
O -2.528341 2.571435 1.016442
N -1.677352 -1.316190 0.168879
N 0.012878 -2.125013 -1.132070
C 0.684165 -1.769844 0.152120
C -0.523117 -1.215533 0.994665
C 1.738478 -0.685140 -0.003699
C 1.260797 -3.012667 0.824161
C -1.359971 -1.829302 -1.146144
C -2.978874 -0.678668 0.471679
C -3.173755 0.625402 -0.314420
C 2.219112 -0.050463 1.154677
C 2.249878 -0.316837 -1.253883
C 3.203129 0.934392 1.059839
C 3.236485 0.671923 -1.344000
C -2.279533 1.726403 0.191424
C 3.716308 1.296868 -0.190675
C -0.022886 2.606150 -0.082289
C -0.302234 3.944110 -0.732928
H 0.497809 -2.586952 -1.886244
H 1.578621 -2.795538 1.854989
H 0.532193 -3.832822 0.874498
H 2.142796 -3.386959 0.288069
H -3.029846 -0.494686 1.572850
H -3.790015 -1.397327 0.203849
H -4.231979 0.958028 -0.233703
H -2.993725 0.447873 -1.401641
H 1.809603 -0.316370 2.134048
H 1.885318 -0.781207 -2.168921
H 3.571433 1.420918 1.962622
H 3.629849 0.952964 -2.320304
H 4.486789 2.062931 -0.263325
H 0.022598 2.667859 1.019623
H 0.873881 2.097233 -0.485931
H 0.535161 4.638228 -0.598140
H -0.482196 3.839370 -1.810303
H -1.196313 4.416997 -0.298405


%chk=000289060-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289060

0 1
O -0.544146 -0.607864 2.058413
O -2.065799 -2.219294 -2.092583
O -1.126193 1.719304 -0.385319
O -2.838265 2.607329 0.934583
N -1.623696 -1.266675 0.054117
N 0.081632 -2.227990 -1.058259
C 0.698477 -1.777168 0.203475
C -0.535004 -1.128027 0.917256
C 1.802480 -0.720640 -0.005030
C 1.200765 -2.981118 1.046004
C -1.271312 -1.945251 -1.160241
C -2.971037 -0.741277 0.295531
C -3.245688 0.599935 -0.444653
C 2.515100 -0.216997 1.114469
C 2.109174 -0.221559 -1.294256
C 3.529075 0.749776 0.940873
C 3.129701 0.741516 -1.468116
C -2.428907 1.752610 0.115509
C 3.847294 1.227840 -0.352207
C -0.175674 2.748968 0.147889
C -0.276326 4.044982 -0.660123
H 0.560473 -2.789682 -1.759395
H 1.491923 -2.648075 2.055228
H 0.402164 -3.736391 1.147562
H 2.078110 -3.446090 0.562677
H -3.086151 -0.615787 1.385978
H -3.696396 -1.491338 -0.064021
H -4.312505 0.848755 -0.316520
H -3.034865 0.463614 -1.518608
H 2.259908 -0.556433 2.123297
H 1.539337 -0.570520 -2.161224
H 4.067825 1.131909 1.814977
H 3.358133 1.113613 -2.473085
H 4.639208 1.972977 -0.486367
H -0.409173 2.913768 1.214025
H 0.808503 2.266698 0.043812
H 0.491946 4.759885 -0.310902
H -0.105460 3.853581 -1.733840
H -1.266429 4.513616 -0.531627


