%chk=000256370.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256370

0 1
O 0.450955 -3.296323 -1.126829
O 0.445717 -2.332811 0.886401
C 2.504732 -0.691750 -0.999582
C 0.980936 -0.988747 -1.130277
C -2.220388 1.228691 -0.641025
C 2.953429 -0.548166 0.466605
C 0.118100 0.209450 -0.697642
C -1.353156 0.031815 -1.090845
C 3.873783 0.668254 0.752142
C -3.721536 0.868022 -0.685847
C -4.342729 0.481107 0.684102
C 3.298278 -1.781667 -1.729548
C -1.939313 2.458917 -1.516718
C 3.146325 1.984175 0.414643
C 4.223257 0.660361 2.255712
C 5.176471 0.575379 -0.063569
C 0.611729 -2.197784 -0.302930
C -5.838541 0.166337 0.460307
C -4.221868 1.656186 1.673619
C -3.655924 -0.762694 1.273873
H 2.681937 0.280798 -1.529224
H 0.768267 -1.219857 -2.208805
H -1.946326 1.488000 0.413856
H 3.465585 -1.472574 0.796113
H 2.066774 -0.480362 1.132116
H 0.521625 1.134091 -1.156439
H 0.204042 0.356993 0.399517
H -1.443462 -0.106683 -2.184596
H -1.749630 -0.898861 -0.638250
H -3.893133 0.047443 -1.406208
H -4.294920 1.723674 -1.092335
H 3.083579 -1.789222 -2.803707
H 3.066230 -2.784343 -1.349782
H 4.377676 -1.631779 -1.612073
H -2.219543 2.285922 -2.561050
H -2.499170 3.331993 -1.164625
H -0.877092 2.724732 -1.503133
H 2.887365 2.037652 -0.648047
H 3.770183 2.853755 0.643753
H 2.219112 2.085912 0.987130
H 4.755039 -0.252627 2.541044
H 3.325552 0.724414 2.878920
H 4.864307 1.506936 2.520138
H 5.708031 -0.359557 0.139478
H 5.857215 1.397515 0.179624
H 4.984760 0.620039 -1.139849
H -6.375192 1.025921 0.048560
H -5.974282 -0.671410 -0.229995
H -6.330215 -0.104166 1.400130
H -4.729864 2.549843 1.299747
H -4.661059 1.407782 2.644376
H -3.172429 1.922525 1.845947
H -3.719053 -1.617885 0.594428
H -4.117769 -1.063283 2.219780
H -2.594489 -0.582784 1.478491
H 0.210090 -4.119798 -0.629521


%chk=000256370-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256370

0 1
O 0.530377 -3.397712 -0.818256
O 0.273566 -2.091223 1.075920
C 2.524804 -0.767762 -0.983364
C 0.965915 -1.017626 -1.056069
C -2.238989 1.283541 -0.515802
C 3.042821 -0.505219 0.466163
C 0.143593 0.252097 -0.716358
C -1.362771 0.108618 -1.035032
C 4.038331 0.688140 0.655248
C -3.760348 0.963469 -0.665627
C -4.509489 0.436345 0.604651
C 3.300056 -1.914673 -1.676652
C -1.885554 2.612072 -1.230274
C 3.336150 2.040367 0.355528
C 4.498348 0.686642 2.139063
C 5.287612 0.545580 -0.255179
C 0.557006 -2.163388 -0.142654
C -5.966420 0.090591 0.190736
C -4.553356 1.538620 1.697760
C -3.839437 -0.837971 1.184076
H 2.675454 0.152728 -1.584644
H 0.740235 -1.333960 -2.092789
H -2.008882 1.413302 0.563042
H 3.536831 -1.427883 0.835535
H 2.188005 -0.333162 1.148456
H 0.574320 1.098202 -1.285084
H 0.265537 0.486370 0.358963
H -1.503445 0.013100 -2.133051
H -1.737364 -0.831909 -0.588249
H -3.890850 0.220565 -1.481311
H -4.292908 1.878470 -0.999149
H 2.976357 -2.043652 -2.726605
H 3.134969 -2.877441 -1.159912
H 4.384673 -1.710011 -1.674585
H -2.092699 2.538958 -2.316073
H -2.489889 3.446731 -0.828838
H -0.820686 2.881429 -1.105862
H 2.998549 2.105556 -0.695705
H 4.027638 2.885072 0.535840
H 2.451839 2.178110 1.006061
H 5.020391 -0.255559 2.392520
H 3.634500 0.789837 2.822764
H 5.192683 1.524912 2.338442
H 5.815512 -0.408037 -0.063288
H 5.999817 1.370809 -0.063704
H 5.019997 0.578737 -1.327608
H -6.482395 0.975511 -0.228690
H -5.981817 -0.707773 -0.575674
H -6.550762 -0.262422 1.061743
H -5.065144 2.446015 1.323545
H -5.103856 1.180987 2.588659
H -3.539754 1.831413 2.028396
H -3.808122 -1.649280 0.431840
H -4.412939 -1.208278 2.055283
H -2.804977 -0.647260 1.523425
H 0.276963 -4.111198 -0.169470


