%chk=000279069.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279069

0 1
O 5.455803 0.427935 1.069825
O 2.405331 2.156948 -0.492971
O 1.938384 -2.293412 -0.544662
O 6.144098 -1.209771 -0.287500
N 0.698195 0.919999 0.311113
N -2.305226 -1.087010 0.784722
C 3.052532 0.261169 0.852828
C 3.729223 -0.687356 -0.158212
C 2.050038 1.178831 0.152299
C 4.213259 1.096971 1.441171
C -0.314375 1.780629 -0.395318
C 0.082957 -0.315464 0.885451
C -1.596106 1.016778 -0.264623
C -1.369750 -0.207031 0.491273
C 5.223967 -0.572987 0.144409
C 3.274450 -2.149226 -0.058784
C -2.848713 1.298221 -0.718274
C -3.903956 0.364651 -0.426475
C -3.600540 -0.808831 0.323040
C -5.245335 0.574547 -0.860974
C -4.634101 -1.748549 0.625950
C -6.224639 -0.342665 -0.558730
C -5.915966 -1.513049 0.190611
H 2.563458 -0.323350 1.667004
H 3.565864 -0.317205 -1.205071
H 4.281315 2.115124 1.006904
H 4.226985 1.131899 2.540680
H -0.010902 1.951268 -1.453300
H -0.356643 2.777850 0.098918
H 0.204650 -0.335497 1.990658
H 0.554478 -1.243997 0.464228
H 3.199652 -2.503384 0.988257
H 3.956100 -2.816744 -0.623012
H -3.075054 2.198288 -1.287737
H 1.904973 -2.188702 -1.519628
H -5.477765 1.471460 -1.434233
H -4.373679 -2.638996 1.201384
H -7.251786 -0.187875 -0.888041
H -6.715877 -2.219765 0.412819


%chk=000279069-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279069

0 1
O 5.233634 0.337117 1.775310
O 2.449239 1.950243 -0.745253
O 2.272819 -2.030054 -1.147832
O 6.309753 -1.346073 0.584543
N 0.675816 0.733428 0.101385
N -2.392517 -1.069161 0.876353
C 3.005423 0.169777 0.823714
C 4.009909 -0.605954 -0.071823
C 2.017259 1.006344 0.000712
C 3.947165 1.088130 1.650191
C -0.288938 1.554050 -0.692234
C 0.043271 -0.433117 0.780450
C -1.613687 0.887250 -0.409082
C -1.424330 -0.257551 0.438493
C 5.315452 -0.621048 0.744462
C 3.571569 -2.031810 -0.456285
C -2.899915 1.206986 -0.826859
C -3.987007 0.373470 -0.393008
C -3.688999 -0.763155 0.462739
C -5.346293 0.619829 -0.769823
C -4.757104 -1.605232 0.903398
C -6.370531 -0.219423 -0.324187
C -6.073647 -1.338859 0.517067
H 2.493320 -0.542643 1.492622
H 4.200178 -0.008514 -0.988406
H 4.147351 2.030166 1.112526
H 3.596729 1.284801 2.674151
H -0.008543 1.541202 -1.763518
H -0.245634 2.611276 -0.368650
H 0.197195 -0.412999 1.876078
H 0.445685 -1.383272 0.379757
H 3.405226 -2.643412 0.445971
H 4.357674 -2.516937 -1.066547
H -3.102080 2.070464 -1.471592
H 2.379594 -1.634416 -2.049556
H -5.572678 1.477579 -1.414815
H -4.502329 -2.453983 1.545332
H -7.407633 -0.024314 -0.617610
H -6.887097 -1.988479 0.857825


