%chk=000278037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278037

0 1
O 5.281766 0.604948 2.799267
O -1.665026 -1.495817 -2.265639
O -3.348344 1.825995 3.055394
O -2.230863 0.034296 2.332539
N 3.334110 0.062418 1.798558
N -0.973739 -1.064407 -0.095853
C 3.193987 -0.393233 -0.599219
C 4.627279 -0.154096 -0.720418
C 2.565198 -0.281144 0.669399
C 5.374508 0.190604 0.427073
C 0.416292 -0.844158 -0.300385
C 1.182516 -0.503402 0.823954
C 2.383305 -0.738545 -1.703178
C 4.738077 0.312712 1.748730
C 1.024446 -0.961322 -1.573043
C 5.305314 -0.254984 -1.957935
C 6.762160 0.427101 0.334957
C -4.084933 -0.423627 -0.152155
C -3.309678 -1.535647 -0.516228
C -3.583427 0.960322 -0.336874
C -1.929787 -1.366812 -1.089078
C 6.671058 -0.020123 -2.036825
C 7.408344 0.323150 -0.888372
C -5.372167 -0.620052 0.370113
C -3.818935 -2.831711 -0.369206
C -3.025601 1.692579 0.727366
C -3.697262 1.562923 -1.597996
C -5.875847 -1.914608 0.521357
C -5.102511 -3.019621 0.150236
C -2.623985 3.023763 0.537863
C -3.276059 2.881657 -1.788415
C -2.747481 3.615281 -0.720669
C -2.812888 1.062704 2.050502
H 0.719067 -0.413829 1.804076
H 2.847365 -0.831661 -2.689882
H 2.875648 0.135223 2.711181
H 0.418554 -1.226481 -2.445945
H 4.747031 -0.520603 -2.855321
H 7.312125 0.691961 1.243519
H -1.316101 -0.943689 0.881925
H 7.182863 -0.101477 -2.996708
H 8.478295 0.504314 -0.964651
H -5.979052 0.240139 0.654039
H -3.213907 -3.691371 -0.663833
H -4.110192 0.992576 -2.433066
H -6.876475 -2.062718 0.928669
H -5.499664 -4.027984 0.265333
H -2.215471 3.591156 1.376985
H -3.361077 3.340010 -2.775362
H -2.428740 4.646884 -0.870719
H -3.203796 1.425309 3.958939


%chk=000278037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278037

0 1
O 5.097117 1.099280 2.733590
O -1.671421 -2.072484 -2.315952
O -2.846884 1.859787 3.288692
O -2.147441 -0.113384 2.305173
N 3.194044 0.355911 1.635395
N -1.029710 -1.082859 -0.267710
C 3.184747 -0.429806 -0.680871
C 4.631221 -0.173152 -0.738679
C 2.483355 -0.151921 0.535396
C 5.302804 0.349129 0.415469
C 0.361497 -0.889066 -0.450428
C 1.093137 -0.377794 0.647477
C 2.419435 -0.945442 -1.762387
C 4.568984 0.635946 1.673740
C 1.040097 -1.179250 -1.672070
C 5.414262 -0.421480 -1.904609
C 6.697264 0.607793 0.391101
C -3.991776 -0.483731 -0.063127
C -3.362200 -1.634268 -0.616994
C -3.440692 0.910036 -0.211790
C -1.954882 -1.606058 -1.169205
C 6.795042 -0.162541 -1.919907
C 7.447066 0.355429 -0.768746
C -5.282052 -0.622533 0.513064
C -4.048005 -2.873349 -0.641776
C -2.982981 1.694510 0.890660
C -3.544271 1.537686 -1.478373
C -5.942459 -1.869801 0.525325
C -5.331489 -2.997090 -0.070917
C -2.707067 3.078257 0.730509
C -3.225988 2.903725 -1.645824
C -2.827524 3.683651 -0.535632
C -2.641995 1.042954 2.179904
H 0.578936 -0.162892 1.592701
H 2.915563 -1.176386 -2.710104
H 2.692109 0.548027 2.507395
H 0.475604 -1.586030 -2.511769
H 4.941385 -0.820999 -2.806853
H 7.156074 1.005755 1.302165
H -1.405794 -0.834416 0.665310
H 7.372609 -0.363197 -2.829288
H 8.523639 0.554382 -0.787970
H -5.777190 0.263472 0.926659
H -3.554504 -3.734037 -1.104582
H -3.895716 0.947322 -2.330982
H -6.936713 -1.955048 0.977193
H -5.848050 -3.962601 -0.086001
H -2.375853 3.657484 1.597450
H -3.306966 3.361218 -2.637698
H -2.600754 4.747481 -0.658848
H -2.539313 1.387281 4.109724


