%chk=000202380.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202380

0 1
O 1.676584 1.082122 -0.651982
O 1.680852 -2.769713 0.453471
N -3.001555 -2.025775 0.063800
N 0.502874 -0.844053 0.776751
C -3.714757 -2.659686 -1.094539
C -3.896744 -0.904889 0.505836
C -4.630391 -1.595360 -1.740214
C -4.756906 -0.465750 -0.701318
C -1.631416 -1.549530 -0.304024
C -0.776521 -1.560560 0.983473
C -0.574032 2.665767 0.329441
C 0.045050 2.701349 -1.073545
C -2.102980 2.760820 0.273437
C 1.660008 -1.545235 0.438495
C 1.556163 2.490531 -1.033718
C -2.717271 2.735232 1.680192
C 2.892228 -0.744756 0.159327
C 2.917221 0.561446 -0.376695
C -4.240427 2.826523 1.633041
C 4.121913 -1.367216 0.425527
C 4.122148 1.237959 -0.619186
C 5.330207 -0.705927 0.193453
C 5.325308 0.592023 -0.326197
H -3.014116 -3.107925 -1.821235
H -4.317171 -3.493346 -0.673031
H -4.538373 -1.315226 1.314838
H -3.327329 -0.063902 0.941315
H -4.198569 -1.220208 -2.682145
H -5.613572 -2.021307 -1.995767
H -5.805759 -0.309239 -0.403261
H -4.402826 0.492263 -1.114881
H -1.174864 -2.245314 -1.042560
H -1.623841 -0.546649 -0.778252
H -0.572287 -2.616582 1.288229
H -1.316277 -1.082710 1.829019
H 0.436386 0.171106 0.633743
H -0.164386 3.487609 0.947774
H -0.268615 1.724381 0.839029
H -0.415145 1.912754 -1.707173
H -0.178536 3.664250 -1.573397
H -2.407035 3.687848 -0.250045
H -2.513336 1.927486 -0.330183
H 2.063833 3.109808 -0.275887
H 2.028677 2.616166 -2.022587
H -2.413036 1.810410 2.209474
H -2.312601 3.571972 2.283436
H -4.681436 1.995446 1.070313
H -4.575673 3.756611 1.159918
H -4.669046 2.801326 2.641809
H 4.115104 -2.391388 0.818132
H 4.134221 2.239161 -1.034427
H 6.271845 -1.203971 0.413103
H 6.269311 1.107345 -0.509227


%chk=000202380-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202380

0 1
O 1.508062 1.401285 -0.372989
O 1.300207 -2.735051 0.643323
N -3.101244 -2.756453 -0.089934
N 0.108454 -0.761380 0.368836
C -3.489713 -3.981184 -0.843954
C -4.248606 -1.828068 -0.315034
C -4.142032 -3.475985 -2.170635
C -4.817408 -2.129375 -1.755881
C -1.781897 -2.188329 -0.468117
C -1.174955 -1.389361 0.713834
C -0.376788 3.429649 0.841573
C 0.190450 3.427516 -0.595457
C -1.792184 4.044058 0.926721
C 1.279131 -1.490824 0.355879
C 1.598991 2.838491 -0.708695
C -2.364678 4.049310 2.362311
C 2.557766 -0.759722 -0.006903
C 2.684447 0.621125 -0.355605
C -3.777310 4.667140 2.444753
C 3.736761 -1.546718 0.009520
C 3.950564 1.172071 -0.672851
C 5.000235 -1.008207 -0.302658
C 5.103161 0.358106 -0.645149
H -2.617902 -4.639101 -0.994321
H -4.238952 -4.539253 -0.247900
H -5.027881 -2.026326 0.445016
H -3.924149 -0.779165 -0.196284
H -3.360057 -3.301188 -2.932037
H -4.862786 -4.200908 -2.588362
H -5.917856 -2.221584 -1.726109
H -4.574156 -1.322088 -2.468828
H -1.089398 -3.017226 -0.696428
H -1.828345 -1.530171 -1.370215
H -1.026712 -2.089228 1.553673
H -1.875392 -0.598306 1.040537
H 0.165521 0.228877 0.105790
H 0.309690 3.996237 1.504727
H -0.399435 2.393827 1.234036
H -0.487494 2.871624 -1.272982
H 0.233389 4.468381 -0.976834
H -1.768421 5.084530 0.539539
H -2.479966 3.481103 0.261117
H 2.293924 3.332678 0.000660
H 1.996527 2.941187 -1.738362
H -2.390218 3.009768 2.748100
H -1.675591 4.609312 3.026897
H -4.492582 4.108554 1.811872
H -3.772185 5.717642 2.097549
H -4.163508 4.655995 3.480351
H 3.609697 -2.600261 0.280795
H 4.048142 2.226961 -0.942245
H 5.891426 -1.643289 -0.279473
H 6.076358 0.796820 -0.892267


