%chk=000242974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242974

0 1
O 6.132952 -0.451385 0.012744
O -6.463121 -0.559411 0.985297
O -6.544431 0.833833 -0.667890
N 0.562593 0.018559 0.419907
N 0.250140 -1.082356 -1.670195
N -5.946397 0.087216 0.089344
C 0.771548 2.506465 0.249953
C 0.168230 1.327504 1.025501
C 2.302294 2.438391 0.288894
C 2.844593 1.036856 0.215903
C 2.004248 -0.101795 0.256943
C -0.257791 -0.454033 -0.658865
C 4.227599 0.860535 0.139233
C 2.553906 -1.393609 0.205324
C 4.756336 -0.442032 0.089456
C 3.934949 -1.575867 0.124282
C -1.737974 -0.282902 -0.433225
C -2.375778 -1.002116 0.587206
C -2.471274 0.558324 -1.282585
C -3.755165 -0.886160 0.761379
C -3.850320 0.682997 -1.114825
C -4.481428 -0.042142 -0.092390
C 6.795191 -1.735784 -0.072868
H 0.420451 3.465486 0.673847
H 0.418928 2.488890 -0.800237
H 0.544943 1.317375 2.075668
H -0.935258 1.414291 1.090896
H 2.676380 2.914078 1.221756
H 2.723520 3.042973 -0.542443
H 4.908012 1.708400 0.109717
H 1.893651 -2.262650 0.217939
H 4.344633 -2.578625 0.080871
H -1.788826 -1.647645 1.245930
H -1.965157 1.114880 -2.073749
H -0.370451 -1.523298 -2.342117
H -4.273597 -1.441592 1.551399
H -4.442560 1.334817 -1.767202
H 6.483152 -2.265001 -0.977944
H 6.604395 -2.322535 0.830031
H 7.850588 -1.440133 -0.134586


%chk=000242974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242974

0 1
O 6.211840 -0.605291 0.279535
O -6.416826 -0.551827 1.389908
O -6.780428 0.186927 -0.738940
N 0.602041 0.318526 0.015914
N 0.108336 -1.116428 -1.821085
N -6.001194 -0.186872 0.221829
C 0.988375 2.749783 0.337494
C 0.166823 1.521696 0.775591
C 2.464405 2.524087 0.712198
C 2.932571 1.108555 0.384432
C 2.024483 0.064646 0.019339
C -0.301322 -0.347482 -0.825719
C 4.311741 0.823923 0.458059
C 2.542953 -1.223304 -0.270825
C 4.817590 -0.462435 0.174154
C 3.921500 -1.495467 -0.195428
C -1.770124 -0.210670 -0.509169
C -2.283871 -0.597753 0.759902
C -2.674644 0.181496 -1.533243
C -3.668998 -0.600728 1.004267
C -4.062124 0.199217 -1.300359
C -4.541072 -0.196494 -0.031256
C 6.775248 -1.924324 -0.014869
H 0.595990 3.657763 0.831586
H 0.876398 2.885778 -0.754601
H 0.311758 1.345734 1.860685
H -0.904792 1.690920 0.597262
H 2.596183 2.705216 1.798675
H 3.112676 3.256558 0.196483
H 5.020944 1.612235 0.734190
H 1.860164 -2.010971 -0.588953
H 4.276906 -2.502530 -0.431680
H -1.589010 -0.909638 1.546826
H -2.280976 0.484055 -2.509388
H -0.682751 -1.584281 -2.300889
H -4.084916 -0.905508 1.968093
H -4.773470 0.510439 -2.069671
H 6.561869 -2.230223 -1.057729
H 6.388804 -2.693403 0.682364
H 7.860623 -1.811127 0.123315


