%chk=000196418.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196418

0 1
O -0.101073 1.189378 -0.056180
O -5.152654 1.970949 -0.192752
O -6.203793 -0.149188 -0.025256
O 4.172794 1.580966 -0.301316
O 5.779655 -0.789149 -0.018161
O 1.566438 2.580584 -0.009003
C 0.150607 -1.208712 0.121142
C -2.073140 -0.099930 0.012961
C -0.640279 -0.066096 0.025090
C 1.601516 -1.074800 0.093747
C -2.698735 -1.372242 0.114008
C 2.170697 0.217795 -0.000961
C -0.518327 -2.466561 0.224713
C -2.835310 1.116021 -0.096836
C -1.886756 -2.546193 0.222247
C -4.186932 0.976895 -0.099209
C -4.134634 -1.479538 0.108514
C -4.832624 -0.315687 0.002969
C 3.579467 0.351726 -0.073853
C 2.445819 -2.205200 0.145077
C 1.316197 1.406336 -0.027654
C 4.399451 -0.791459 -0.044738
C 3.822728 -2.072846 0.069881
C -6.447430 1.293662 -0.149988
C 4.349873 2.403428 0.888452
C 6.442820 0.061874 -0.992661
H 0.087961 -3.371727 0.306269
H -2.322153 2.076173 -0.172216
H -2.384443 -3.512364 0.302363
H -4.617158 -2.449498 0.185296
H 2.004857 -3.200065 0.234733
H 4.483017 -2.942389 0.102564
H -6.952885 1.464918 -1.109899
H -6.973689 1.622680 0.756098
H 3.372618 2.694863 1.290053
H 4.870324 3.276213 0.475676
H 4.960894 1.871935 1.621351
H 7.498555 -0.127797 -0.768568
H 6.176722 1.113188 -0.831318
H 6.181304 -0.261643 -2.003038


%chk=000196418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196418

0 1
O -0.026546 1.158699 -0.227216
O -5.132806 2.031018 -0.057093
O -6.232225 -0.082069 0.209930
O 4.374161 1.512579 0.076985
O 5.892254 -0.832847 -0.074978
O 1.749042 2.516164 -0.630310
C 0.182234 -1.263795 0.046693
C -2.039817 -0.111901 0.020955
C -0.608855 -0.103497 -0.040413
C 1.644530 -1.134313 -0.006786
C -2.698767 -1.392599 0.182074
C 2.243763 0.178072 -0.078170
C -0.505508 -2.516180 0.201921
C -2.801070 1.105819 -0.077379
C -1.893326 -2.577630 0.268066
C -4.175946 0.989948 -0.010899
C -4.134962 -1.457603 0.249198
C -4.832931 -0.268378 0.149497
C 3.675610 0.313263 -0.032501
C 2.493680 -2.269905 0.011720
C 1.393812 1.360734 -0.316604
C 4.493530 -0.854857 -0.104254
C 3.886398 -2.130110 -0.070510
C -6.457272 1.361492 -0.070354
C 3.971508 2.527773 1.076658
C 6.602346 0.046863 -1.032009
H 0.069418 -3.442779 0.279526
H -2.294992 2.064536 -0.200345
H -2.392079 -3.545201 0.390959
H -4.645677 -2.415850 0.373999
H 2.069252 -3.274990 0.066923
H 4.546363 -3.002981 -0.077529
H -6.905767 1.465777 -1.075083
H -7.083041 1.787213 0.729372
H 3.392770 3.320047 0.580855
H 4.918332 2.914025 1.487290
H 3.368926 2.066557 1.880281
H 7.669940 -0.138982 -0.841334
H 6.347660 1.103860 -0.859716
H 6.348356 -0.241471 -2.069820


