%chk=000201727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201727

0 1
O 5.606948 -1.084649 -0.019200
O -0.614175 2.405219 -2.053803
O -2.258456 3.088617 -0.712122
N 2.860073 -0.294799 0.023381
C -0.436562 1.699410 0.254160
C 0.884365 1.133613 -0.316174
C 1.597583 0.194821 0.668863
C -1.344135 0.587962 0.782659
C 3.959225 0.719288 0.142464
C 3.300017 -1.593168 0.633747
C -0.109160 2.784947 1.296813
C -1.235384 2.459846 -0.821488
C -1.856442 -0.441355 -0.093570
C 5.203108 0.180784 -0.581792
C 4.561849 -2.075657 -0.099711
C -1.688324 0.562912 2.116557
C -2.732309 -1.425166 0.442908
C -1.532213 -0.535474 -1.485494
C -2.549847 -0.437322 2.649320
C -3.068768 -1.406225 1.833663
C -3.278145 -2.440328 -0.407139
C -2.063871 -1.517827 -2.282308
C -2.957161 -2.484259 -1.739398
H 0.691274 0.585581 -1.268744
H 1.549148 1.968280 -0.614492
H 1.770509 0.703121 1.640856
H 0.938446 -0.677726 0.882584
H 4.213939 0.960991 1.196706
H 3.619806 1.660599 -0.340263
H 2.483840 -2.335622 0.500974
H 3.505191 -1.514241 1.722675
H 0.445874 2.370591 2.146752
H 0.514501 3.578586 0.866216
H -1.019268 3.265005 1.685622
H 5.022496 0.051240 -1.663581
H 6.092826 0.811085 -0.411779
H 5.023840 -2.948532 0.392844
H 4.357141 -2.295268 -1.162573
H -1.321350 1.315017 2.815352
H -0.825060 0.181234 -1.920631
H -2.790537 -0.406200 3.711136
H -3.739972 -2.170581 2.222657
H -3.954721 -3.174487 0.028516
H -1.115216 2.903670 -2.753652
H -1.807924 -1.574934 -3.339581
H -3.370597 -3.249197 -2.394329


%chk=000201727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201727

0 1
O 5.755422 -1.030872 0.124526
O -0.421142 2.740468 -2.051483
O -2.353885 2.931383 -0.794413
N 2.929824 -0.326183 0.098582
C -0.441195 1.667637 0.170176
C 0.900574 1.063229 -0.369207
C 1.635193 0.156435 0.642636
C -1.374899 0.561231 0.727548
C 3.988233 0.716753 0.091390
C 3.421676 -1.538039 0.806450
C -0.111802 2.770696 1.230896
C -1.199397 2.470079 -0.908837
C -1.967395 -0.435251 -0.148533
C 5.264260 0.171073 -0.569887
C 4.700081 -2.058492 0.130276
C -1.623060 0.475271 2.102943
C -2.783474 -1.488887 0.431990
C -1.804301 -0.439836 -1.577401
C -2.427688 -0.560478 2.668920
C -2.996518 -1.529881 1.848406
C -3.378326 -2.480535 -0.416794
C -2.397395 -1.417154 -2.379442
C -3.191238 -2.453046 -1.798493
H 0.723780 0.462405 -1.275953
H 1.546904 1.904850 -0.676384
H 1.780424 0.682349 1.620969
H 1.008315 -0.730573 0.848634
H 4.229994 1.054236 1.132406
H 3.639029 1.596815 -0.478457
H 2.639206 -2.319153 0.763904
H 3.641614 -1.326262 1.884038
H 0.481650 2.357790 2.063213
H 0.489137 3.568113 0.757955
H -1.033729 3.222445 1.633775
H 5.053929 -0.071246 -1.633998
H 6.087532 0.902204 -0.510023
H 5.124049 -2.913634 0.682385
H 4.468708 -2.362726 -0.913349
H -1.200259 1.219425 2.782387
H -1.210155 0.336450 -2.066261
H -2.592718 -0.580602 3.751544
H -3.616717 -2.330077 2.269367
H -3.990942 -3.263997 0.045460
H -0.955644 3.317936 -2.663206
H -2.254208 -1.388598 -3.465213
H -3.651045 -3.214349 -2.437842


