%chk=000287599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287599

0 1
O -4.764322 1.806026 1.076979
O 5.555496 -0.325620 0.361637
C -2.286519 -0.463523 -0.707231
C -0.777502 -0.759168 -0.523244
C -2.782601 0.586565 0.314258
C 0.037826 0.555744 -0.634604
C -1.972002 1.886494 0.172175
C -0.474560 1.626912 0.354142
C -3.132128 -1.748770 -0.628953
C -4.286973 0.868491 0.097328
C -0.440788 -1.465052 0.800859
C -4.621799 -1.448857 -0.840119
C -5.128208 -0.415755 0.170941
C 1.510943 0.311361 -0.393150
C 1.034786 -1.877951 0.829172
C 1.972001 -0.814208 0.325261
C 2.437417 1.242759 -0.878322
C 3.341021 -0.983464 0.552651
C 3.810438 1.092329 -0.663899
C 4.243418 -0.025754 0.057297
C 6.579850 0.588618 -0.095375
H -2.414824 -0.031812 -1.732503
H -0.460613 -1.428326 -1.362033
H -2.639442 0.183464 1.344313
H -0.095269 0.947269 -1.674778
H -2.328932 2.626759 0.915458
H -2.160127 2.348433 -0.815870
H 0.091756 2.566353 0.214140
H -0.265069 1.304098 1.392491
H -2.985629 -2.242357 0.351547
H -2.783503 -2.473959 -1.387679
H -4.471836 1.421220 -0.851285
H -1.081685 -2.355446 0.941580
H -0.660529 -0.792431 1.653163
H -4.792213 -1.082511 -1.871259
H -5.210022 -2.381776 -0.750107
H -6.190609 -0.171168 -0.018862
H -5.097592 -0.834296 1.193891
H 1.181070 -2.790550 0.210579
H 1.315700 -2.172548 1.861601
H 2.085868 2.110708 -1.437827
H -4.627461 1.474040 1.982590
H 3.726479 -1.838012 1.102674
H 4.504533 1.827991 -1.050553
H 7.493025 0.110135 0.281413
H 6.438853 1.574399 0.356802
H 6.585479 0.637945 -1.187888


%chk=000287599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287599

0 1
O -4.858051 1.909496 1.034410
O 5.679304 -0.323025 0.350400
C -2.314899 -0.486729 -0.648316
C -0.793992 -0.777302 -0.463717
C -2.834566 0.613181 0.324940
C 0.040272 0.531020 -0.593345
C -1.991664 1.902014 0.175623
C -0.486383 1.633225 0.376871
C -3.188230 -1.763759 -0.588670
C -4.338960 0.895493 0.085366
C -0.412259 -1.509227 0.848666
C -4.674107 -1.444639 -0.870095
C -5.197912 -0.383627 0.126733
C 1.533741 0.283729 -0.379229
C 1.065452 -1.956879 0.797302
C 2.016241 -0.861419 0.321015
C 2.474887 1.229604 -0.849851
C 3.403428 -1.011829 0.539042
C 3.863636 1.082804 -0.643708
C 4.326663 -0.052496 0.065955
C 6.670256 0.643379 -0.122985
H -2.425677 -0.066355 -1.676339
H -0.496804 -1.451836 -1.297888
H -2.729071 0.235172 1.368401
H -0.104489 0.922383 -1.624277
H -2.352180 2.667832 0.886847
H -2.156865 2.314662 -0.843179
H 0.092668 2.562992 0.216322
H -0.291796 1.328485 1.424327
H -3.112551 -2.227450 0.415728
H -2.807639 -2.509749 -1.314951
H -4.460003 1.393044 -0.896345
H -1.050588 -2.399380 0.997227
H -0.573549 -0.848837 1.722005
H -4.781514 -1.060888 -1.905598
H -5.287776 -2.363237 -0.803687
H -6.249971 -0.117916 -0.086380
H -5.168022 -0.805073 1.155362
H 1.149503 -2.818610 0.101668
H 1.390949 -2.329675 1.787566
H 2.112617 2.107958 -1.399841
H -4.821041 1.518183 1.945665
H 3.792457 -1.883537 1.077507
H 4.555239 1.836980 -1.030432
H 7.641515 0.244091 0.204961
H 6.507877 1.643243 0.325856
H 6.657055 0.729301 -1.227529


