%chk=000270319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270319

0 1
O -0.382484 -2.813827 1.811403
O 0.662892 -1.088750 2.577647
O -2.856455 0.295048 -1.751438
O -1.433077 2.894826 0.335749
O 2.913179 0.631407 -1.411657
N 0.098863 -1.702395 1.684510
C 0.037516 -1.030436 0.278084
C -1.202882 -1.592433 -0.450141
C -0.020941 0.492271 0.496244
C 1.318251 -1.487996 -0.460694
C -2.547873 -1.145986 0.127596
C -0.071796 1.290853 -0.805513
C 2.639575 -1.113900 0.213530
C -3.104089 0.077887 -0.582540
C -0.706621 2.650431 -0.606211
C 3.293410 0.117978 -0.381646
C -3.956653 0.990455 0.235019
C -0.409635 3.667224 -1.666124
C 4.457801 0.660770 0.392485
H -1.153776 -1.297114 -1.525425
H -1.159227 -2.704211 -0.445355
H 0.851575 0.821121 1.101164
H -0.904758 0.754034 1.124016
H 1.283043 -2.586562 -0.615248
H 1.298152 -1.046326 -1.487285
H -2.487342 -0.984297 1.221308
H -3.289524 -1.968555 0.013371
H -0.664635 0.757193 -1.588873
H 0.946053 1.382641 -1.249737
H 3.352147 -1.963376 0.128935
H 2.516827 -0.971777 1.312363
H -3.324355 1.790334 0.680238
H -4.487833 0.501181 1.056503
H -4.697388 1.517432 -0.385103
H -0.787032 3.345286 -2.648015
H 0.667717 3.846740 -1.779949
H -0.883613 4.633838 -1.438305
H 5.188345 -0.112026 0.661941
H 4.130877 1.134101 1.330191
H 4.993464 1.432817 -0.182138


%chk=000270319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270319

0 1
O 0.219077 -2.891137 1.679218
O 0.300541 -0.846926 2.662494
O -3.005950 0.362964 -1.651598
O -1.454085 2.983395 0.225950
O 3.096568 0.755506 -1.244800
N 0.209564 -1.604391 1.627751
C 0.103490 -0.945200 0.188978
C -1.203855 -1.531224 -0.423446
C 0.082232 0.586005 0.370795
C 1.336591 -1.486367 -0.597218
C -2.513442 -1.076411 0.260377
C -0.024814 1.378498 -0.950613
C 2.714687 -1.273052 0.071053
C -3.226342 0.094264 -0.438369
C -0.717990 2.733483 -0.768659
C 3.408635 0.058947 -0.240591
C -4.200625 0.903091 0.396800
C -0.498849 3.751005 -1.876245
C 4.516729 0.481290 0.712330
H -1.248534 -1.239783 -1.489741
H -1.115128 -2.630618 -0.386967
H 0.987700 0.906677 0.916702
H -0.762034 0.874755 1.021570
H 1.179047 -2.566457 -0.763500
H 1.341824 -0.989501 -1.584825
H -2.372450 -0.832313 1.330814
H -3.242699 -1.914040 0.250652
H -0.646119 0.841281 -1.697414
H 0.965928 1.520784 -1.417923
H 3.409347 -2.059478 -0.294423
H 2.680432 -1.418343 1.167890
H -3.622990 1.708044 0.895003
H -4.682937 0.294567 1.181482
H -4.959569 1.379232 -0.244068
H -0.671978 3.288334 -2.865575
H 0.552985 4.096482 -1.863992
H -1.167195 4.615780 -1.745298
H 5.150354 -0.377833 0.998766
H 4.066192 0.870907 1.646620
H 5.133363 1.273682 0.260921


