%chk=000282106.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282106

0 1
O -1.445210 6.320743 1.040981
O -0.995267 -1.121471 -2.226385
O -5.554892 -4.107012 1.107310
O 7.008053 -1.818177 0.590093
N -1.126824 0.229656 -0.403774
N 1.286841 0.764845 -0.503376
C -0.079960 1.176558 -0.906478
C -0.391727 2.545435 -0.331610
C 0.212353 3.010447 0.841428
C -1.323371 3.358769 -1.007334
C -1.518846 -0.887095 -1.144340
C -2.595425 -1.725702 -0.546755
C -0.099917 4.274006 1.355413
C -1.651862 4.615317 -0.517708
C -1.028940 5.062541 0.668133
C 1.749327 -0.399204 -0.836374
C 3.125755 -0.783954 -0.467582
C -2.588311 -2.088261 0.812947
C -3.611081 -2.193054 -1.393182
C -3.596486 -2.889010 1.330323
C -4.640176 -2.994166 -0.895280
C 3.572238 -2.080666 -0.767796
C 4.000115 0.120603 0.173084
C -4.622326 -3.332733 0.465070
C 4.866166 -2.489421 -0.437363
C 5.290785 -0.261776 0.510845
C 5.712608 -1.572281 0.200032
C -0.858285 6.904299 2.229157
C -6.656239 -4.637344 0.327955
C 7.564293 -3.127125 0.316151
H -0.142721 1.201751 -2.037800
H -1.544627 0.448047 0.496736
H 0.945364 2.385989 1.360128
H -1.793767 2.999179 -1.924061
H 0.381468 4.620462 2.262705
H -2.367156 5.259543 -1.022872
H 1.186855 -1.171564 -1.399907
H -1.780603 -1.750858 1.465402
H -3.590233 -1.928234 -2.454624
H -3.614561 -3.185555 2.376896
H -5.423505 -3.344014 -1.559108
H 2.904658 -2.785674 -1.267188
H 3.649176 1.132277 0.400088
H 5.193755 -3.494693 -0.676626
H 5.979892 0.420278 1.003272
H -1.356686 7.881733 2.268387
H -1.104180 6.302884 3.108761
H 0.221913 7.020210 2.101867
H -6.281429 -5.303144 -0.454752
H -7.216014 -5.199159 1.087819
H -7.259708 -3.821720 -0.080397
H 7.590562 -3.310841 -0.761727
H 7.001488 -3.898251 0.849642
H 8.579368 -3.028313 0.722971


%chk=000282106-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282106

0 1
O -1.484269 6.374183 1.479241
O -1.392632 -0.663118 -2.501584
O -5.569622 -4.343571 0.815339
O 7.110202 -1.891460 0.114883
N -1.123085 0.264755 -0.388497
N 1.296029 0.899747 -0.644963
C -0.125454 1.262816 -0.840573
C -0.431970 2.621743 -0.199425
C 0.539230 3.345539 0.524795
C -1.730808 3.181612 -0.343324
C -1.697497 -0.652488 -1.264379
C -2.700816 -1.610080 -0.685583
C 0.234942 4.598218 1.106808
C -2.048997 4.426782 0.224667
C -1.064220 5.140391 0.955065
C 1.640402 -0.334449 -0.398938
C 3.049441 -0.745612 -0.264926
C -2.861132 -1.855304 0.707419
C -3.522067 -2.320888 -1.594626
C -3.820907 -2.769058 1.172316
C -4.492868 -3.237253 -1.145747
C 3.361504 -2.093257 0.045559
C 4.121225 0.178454 -0.443700
C -4.645688 -3.460278 0.247235
C 4.697915 -2.525910 0.183603
C 5.452718 -0.234629 -0.311373
C 5.747285 -1.589661 0.005252
C -0.499571 7.160767 2.224380
C -6.445010 -5.093055 -0.092265
C 7.479068 -3.273874 0.433155
H -0.265249 1.325270 -1.940949
H -1.461621 0.344371 0.571770
H 1.543176 2.921419 0.617497
H -2.495816 2.637665 -0.910325
H 1.010177 5.134127 1.662853
H -3.043825 4.868987 0.114481
H 0.890208 -1.142301 -0.272245
H -2.220380 -1.360413 1.447120
H -3.375293 -2.138420 -2.664273
H -3.947859 -2.971744 2.239808
H -5.114199 -3.764942 -1.875130
H 2.546951 -2.816578 0.178321
H 3.874819 1.215011 -0.694985
H 4.906618 -3.572687 0.422872
H 6.286601 0.460493 -0.448877
H -1.031248 8.074952 2.526900
H -0.147026 6.619545 3.124284
H 0.368022 7.426558 1.589281
H -5.858147 -5.744829 -0.767652
H -7.075786 -5.709651 0.564178
H -7.080468 -4.411700 -0.689843
H 7.126720 -3.973829 -0.348993
H 7.074741 -3.580746 1.417192
H 8.578232 -3.276519 0.466099


