%chk=000290769.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290769

0 1
O -0.744380 0.654811 0.996483
O 2.748307 0.080340 2.589096
O 1.093440 2.560208 -0.956886
O -1.393014 1.746379 2.871618
N 1.753530 1.526390 1.040127
C -2.054415 -0.020718 0.886220
C 3.254872 -0.032934 0.176799
C 2.747615 0.732747 -0.911177
C 0.816578 2.188306 1.949849
C 2.614499 0.436350 1.450346
C 1.753566 1.730012 -0.390468
C -2.739470 0.508522 -0.352131
C -1.701821 -1.486884 0.815995
C -0.555170 1.530387 2.029010
C 4.186438 -1.028452 -0.023108
C 3.171557 0.506129 -2.202589
C -4.042334 0.067068 -0.633044
C -1.910553 -2.300265 1.939492
C -2.112290 1.424686 -1.204554
C -1.153005 -2.034942 -0.352063
C 4.622622 -1.264255 -1.349209
C 4.128352 -0.516310 -2.411109
C -4.710543 0.545777 -1.761847
C -1.581527 -3.657494 1.887438
C -2.787900 1.902299 -2.331956
C -0.824250 -3.392421 -0.398199
C -4.085286 1.464859 -2.612395
C -1.039551 -4.204760 0.719750
H -2.652889 0.231572 1.799690
H 1.252919 2.208360 2.984133
H 0.669228 3.253043 1.628884
H 4.576178 -1.618748 0.807600
H 2.785851 1.090324 -3.039257
H -4.530975 -0.650186 0.024596
H -2.323461 -1.877945 2.855403
H -1.096455 1.770491 -0.987963
H -0.985965 -1.398004 -1.221462
H 5.359011 -2.049322 -1.529964
H 4.476576 -0.713107 -3.426599
H -5.720948 0.203790 -1.979224
H -1.744813 -4.288312 2.759824
H -2.297926 2.619131 -2.989596
H -0.400914 -3.817126 -1.306563
H -4.609843 1.838649 -3.489437
H -0.784443 -5.262342 0.682148


%chk=000290769-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290769

0 1
O -0.586063 0.339420 1.019882
O 3.143364 -0.956004 1.745587
O 1.196136 2.951265 -0.013152
O -1.079020 1.090092 3.180772
N 2.007751 1.051167 1.161202
C -2.041849 -0.066031 0.817068
C 3.418659 0.166749 -0.465159
C 2.835793 1.345766 -0.991860
C 1.229159 1.203371 2.380433
C 2.893134 -0.045458 0.920178
C 1.916110 1.923188 0.038876
C -2.397458 0.284810 -0.624945
C -2.181505 -1.521906 1.228038
C -0.266562 0.881023 2.252945
C 4.328931 -0.596456 -1.210808
C 3.144619 1.800620 -2.282080
C -3.394673 -0.450950 -1.314067
C -2.843842 -1.848387 2.436238
C -1.818733 1.416237 -1.254794
C -1.618077 -2.560401 0.442625
C 4.647362 -0.145054 -2.518289
C 4.064327 1.035174 -3.045567
C -3.800523 -0.068233 -2.612185
C -2.954798 -3.194773 2.851000
C -2.220518 1.791841 -2.555368
C -1.720529 -3.903851 0.859923
C -3.213189 1.053346 -3.240076
C -2.392827 -4.225366 2.063783
H -2.628243 0.566617 1.511922
H 1.655274 0.520387 3.138308
H 1.305265 2.236120 2.762377
H 4.772732 -1.505446 -0.793044
H 2.688299 2.712731 -2.678985
H -3.855498 -1.322461 -0.836738
H -3.258559 -1.045678 3.057040
H -1.050925 1.997893 -0.735236
H -1.097535 -2.310395 -0.488716
H 5.353304 -0.715182 -3.131514
H 4.328821 1.358236 -4.058062
H -4.573530 -0.646447 -3.130849
H -3.470541 -3.437152 3.786598
H -1.760923 2.666266 -3.029672
H -1.277003 -4.699934 0.251647
H -3.526187 1.348987 -4.247790
H -2.472929 -5.269638 2.386218


