%chk=000244498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244498

0 1
O -0.471430 -0.508209 -0.019079
O 0.112843 1.742597 -0.146403
C -2.276000 1.130902 0.069595
C -1.861064 -0.296197 -0.407457
C 0.461365 0.418549 -0.582812
C 1.818065 0.101098 0.070358
C -1.227655 2.126904 -0.503786
C -2.571319 -1.505383 0.253153
C -3.644282 1.531741 -0.496735
C -2.270510 1.223299 1.597822
C 2.291375 -1.303270 -0.342629
C 2.858379 1.166165 -0.325082
C -4.046625 -1.586280 -0.146823
C -1.852322 -2.803758 -0.137998
C 3.615943 -1.645476 0.355289
C 4.252319 0.751127 0.037626
C 4.595045 -0.508330 0.327542
H -1.921547 -0.363029 -1.514605
H 0.430074 0.368114 -1.687092
H 1.677286 0.126660 1.180836
H -1.292704 2.214767 -1.600902
H -1.311725 3.128246 -0.045895
H -2.496387 -1.386672 1.363390
H -3.891934 2.569096 -0.245816
H -3.690182 1.431909 -1.585450
H -4.445330 0.902895 -0.076632
H -2.999292 0.546718 2.054032
H -1.273109 0.950250 1.979909
H -2.490795 2.235746 1.948176
H 2.422865 -1.353961 -1.439590
H 1.514607 -2.049346 -0.084534
H 2.594676 2.127744 0.164553
H 2.815737 1.366413 -1.415916
H 4.062755 -2.543405 -0.115822
H 3.422955 -1.922009 1.413989
H -4.172428 -1.674411 -1.231116
H -4.524886 -2.462131 0.306709
H -4.607000 -0.699375 0.183989
H -1.921226 -3.004418 -1.211219
H -2.270838 -3.664490 0.391766
H -0.783467 -2.742061 0.115230
H 4.984254 1.557241 0.035625
H 5.618816 -0.778271 0.580108


%chk=000244498-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244498

0 1
O -0.440859 -0.526366 0.181138
O 0.132078 1.793193 0.046019
C -2.314226 1.115430 0.082368
C -1.840947 -0.333497 -0.305043
C 0.495562 0.439812 -0.373393
C 1.899335 0.122516 0.144511
C -1.219063 2.099294 -0.442778
C -2.590162 -1.567521 0.266561
C -3.613234 1.535750 -0.656715
C -2.461849 1.270835 1.613750
C 2.357041 -1.290962 -0.290596
C 2.916167 1.191257 -0.330882
C -4.117090 -1.575330 0.017406
C -1.966908 -2.862730 -0.314746
C 3.718738 -1.647961 0.350799
C 4.350464 0.766535 -0.073386
C 4.712869 -0.503484 0.249746
H -1.830375 -0.398127 -1.422069
H 0.438342 0.394650 -1.492563
H 1.846439 0.149783 1.251091
H -1.215089 2.085635 -1.558061
H -1.432322 3.125129 -0.097383
H -2.409994 -1.564473 1.360114
H -3.737359 2.635109 -0.603020
H -3.581192 1.255441 -1.727345
H -4.514437 1.084698 -0.214527
H -3.256592 0.614589 2.012180
H -1.513297 1.019722 2.117963
H -2.726219 2.313619 1.872411
H 2.457165 -1.314465 -1.395537
H 1.591069 -2.036304 -0.012259
H 2.704118 2.152467 0.172844
H 2.775216 1.388581 -1.416700
H 4.139677 -2.551518 -0.134359
H 3.574577 -1.919744 1.418475
H -4.356051 -1.414214 -1.050966
H -4.528798 -2.560430 0.304693
H -4.649179 -0.811632 0.609363
H -2.166284 -2.938171 -1.402179
H -2.406119 -3.754095 0.170030
H -0.876112 -2.879712 -0.159707
H 5.120933 1.546863 -0.150856
H 5.769268 -0.732473 0.449913


