%chk=000240075.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240075

0 1
O -4.157747 1.653873 -0.794014
O 2.956273 2.759901 -0.506239
C -0.523931 -2.430402 0.656383
C 0.704189 -2.426116 -0.303452
C -1.511807 -1.361164 0.233769
C 1.304527 -1.036049 -0.374057
C -1.199456 -3.818993 0.703331
C 1.766312 -3.460730 0.130358
C -2.564501 0.760455 0.663000
C 2.487200 0.788953 0.657778
C -1.670791 -0.217005 1.052339
C 1.949621 -0.479182 0.755577
C -2.945983 2.067261 1.289762
C 3.223454 1.637346 1.650100
C -2.248282 -1.489277 -0.949423
C 1.211536 -0.304806 -1.564704
C -3.970652 2.663448 0.288678
C 3.556662 2.923842 0.848923
C -3.300243 0.601009 -0.542482
C 2.380182 1.505094 -0.564384
C -2.277001 -3.893565 1.780921
C 2.871672 -3.614093 -0.910147
C -3.164512 -0.507102 -1.363768
C 1.751769 0.987125 -1.685922
C -3.511339 3.934633 -0.395826
C 5.037037 3.160425 0.628340
H -0.153822 -2.198255 1.686565
H 0.341101 -2.717899 -1.321488
H -0.429871 -4.597493 0.889538
H -1.637872 -4.064204 -0.283319
H 2.205008 -3.172961 1.104866
H 1.276061 -4.442347 0.301709
H -1.089817 -0.110614 1.964950
H 2.019667 -1.045626 1.680631
H -3.390515 1.927382 2.290745
H -2.066764 2.723410 1.425546
H 2.604178 1.860995 2.536517
H 4.132365 1.131819 2.023266
H -2.116367 -2.372314 -1.574317
H 0.701435 -0.736475 -2.426123
H -4.987426 2.753980 0.719558
H 3.036747 3.819392 1.243332
H -1.864693 -3.725716 2.781608
H -3.055416 -3.136011 1.618237
H -2.767652 -4.872830 1.784541
H 3.375699 -2.657164 -1.100373
H 3.633464 -4.327635 -0.578610
H 2.480474 -3.969783 -1.869700
H -3.734678 -0.608253 -2.280489
H 1.676316 1.552629 -2.608357
H -2.525663 3.806084 -0.865446
H -4.202247 4.213893 -1.203890
H -3.447593 4.775546 0.302067
H 5.556922 3.398843 1.561802
H 5.523759 2.283076 0.180564
H 5.198007 3.991951 -0.072667


%chk=000240075-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240075

0 1
O -4.568362 1.439164 -0.831455
O 3.129979 2.919032 -0.225884
C -0.503935 -2.334096 0.697417
C 0.687792 -2.289885 -0.341793
C -1.603303 -1.351231 0.277890
C 1.331875 -0.898629 -0.344821
C -1.068024 -3.767889 0.924708
C 1.741061 -3.413488 -0.113423
C -2.843974 0.733811 0.608851
C 2.673519 0.828266 0.759232
C -1.845479 -0.164474 1.021079
C 2.095820 -0.450779 0.771295
C -3.336263 2.041834 1.212492
C 3.491774 1.575789 1.803579
C -2.395636 -1.603992 -0.874897
C 1.171712 -0.024601 -1.450153
C -4.299218 2.598948 0.112291
C 3.980638 2.844242 1.029806
C -3.607565 0.452743 -0.545794
C 2.496048 1.670090 -0.363370
C -2.232860 -3.816283 1.937458
C 2.901147 -3.384713 -1.132833
C -3.406276 -0.712446 -1.306219
C 1.747389 1.270112 -1.482014
C -3.704153 3.749397 -0.706648
C 5.451760 2.784914 0.604244
H -0.096288 -1.989660 1.671912
H 0.246169 -2.458712 -1.346472
H -0.255678 -4.422133 1.293116
H -1.399891 -4.196809 -0.043360
H 2.149281 -3.340066 0.915989
H 1.239644 -4.396955 -0.179968
H -1.240140 0.046523 1.911270
H 2.236683 -1.107541 1.638935
H -3.871640 1.866164 2.164965
H -2.516717 2.754876 1.414915
H 2.868871 1.852985 2.675325
H 4.349486 0.988917 2.179667
H -2.225406 -2.519183 -1.455508
H 0.576372 -0.360546 -2.307586
H -5.288551 2.872287 0.516708
H 3.766457 3.778760 1.575632
H -1.925103 -3.396021 2.914276
H -3.100994 -3.234437 1.581917
H -2.563714 -4.857650 2.107741
H 3.479517 -2.447058 -1.060789
H 3.594146 -4.230205 -0.965907
H 2.518181 -3.461487 -2.168481
H -4.009491 -0.913670 -2.196197
H 1.618960 1.933976 -2.341538
H -2.716906 3.464919 -1.112820
H -4.366741 4.009296 -1.549779
H -3.576054 4.646403 -0.071963
H 6.111434 2.827163 1.491282
H 5.659520 1.847866 0.057034
H 5.698121 3.634462 -0.055246


