%chk=000257630.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257630

0 1
O 5.361581 -0.388472 0.299745
O -5.687219 0.643346 -1.841557
O 5.652677 2.258183 0.408464
C -0.340079 -1.046212 0.337756
C 0.969815 -1.122736 -0.459731
C -1.023219 0.311691 0.006856
C 1.947531 0.016573 -0.029680
C -2.369149 0.483862 0.783613
C -0.068015 1.504447 0.248167
C -3.304416 -0.745266 0.535736
C 1.300820 1.351996 -0.437243
C 3.229538 -0.376765 -0.840921
C -1.278109 -2.209304 -0.021277
C 1.831300 -2.393178 -0.377272
C -2.594373 -2.093661 0.748893
C 3.241335 -1.929015 -0.810487
C -3.062667 1.790022 0.282817
C 2.270936 0.013434 1.470628
C -2.126918 0.598783 2.300066
C -3.959795 -0.676165 -0.852569
C -4.560406 1.654121 0.008711
C 4.490338 0.228997 -0.272249
C -4.830727 0.550025 -0.991192
C 4.662166 1.734025 -0.472950
H -0.115438 -1.088376 1.430612
H 0.711668 -0.971857 -1.540039
H -1.275444 0.297249 -1.083551
H 0.081817 1.645477 1.337815
H -0.541841 2.437942 -0.111224
H -4.128375 -0.693884 1.295219
H 1.179662 1.405970 -1.534896
H 1.955850 2.203178 -0.161684
H 3.116361 -0.033720 -1.895961
H -0.790322 -3.174550 0.212952
H -1.472329 -2.228123 -1.110247
H 1.448445 -3.192827 -1.029542
H 1.846686 -2.805003 0.645884
H -3.270856 -2.921303 0.460335
H -2.403039 -2.233535 1.831845
H 4.011859 -2.297204 -0.105554
H 3.510048 -2.332300 -1.799297
H -2.573781 2.144770 -0.647600
H -2.903926 2.603337 1.016827
H 2.855187 0.891275 1.767266
H 1.357760 0.012122 2.078849
H 2.847049 -0.874445 1.760409
H -1.439073 1.418256 2.539183
H -3.059026 0.784838 2.843383
H -1.685415 -0.318090 2.707076
H -4.560363 -1.585906 -1.054229
H -3.190027 -0.665460 -1.651963
H -4.975363 2.612465 -0.365640
H -5.119300 1.442135 0.942939
H 3.741189 2.306130 -0.227646
H 4.967947 1.965309 -1.511899
H 6.305444 1.544802 0.644653


%chk=000257630-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257630

0 1
O 5.328675 -0.094031 0.514655
O -5.832430 0.696391 -1.912258
O 6.048364 2.294409 -0.458336
C -0.348806 -1.078732 0.423217
C 1.017639 -1.106149 -0.294775
C -1.016435 0.312852 0.174437
C 1.991116 0.028864 0.164924
C -2.451199 0.461861 0.811404
C -0.065397 1.486631 0.548924
C -3.358923 -0.765883 0.409429
C 1.322736 1.389779 -0.139821
C 3.238009 -0.335881 -0.749728
C -1.275994 -2.210620 -0.078041
C 1.885420 -2.386594 -0.243494
C -2.657425 -2.134218 0.601612
C 3.307616 -1.899496 -0.685979
C -3.103004 1.787216 0.258130
C 2.380231 -0.071603 1.663672
C -2.400130 0.537282 2.362612
C -3.949067 -0.592960 -1.013977
C -4.621728 1.678920 -0.018533
C 4.522952 0.357677 -0.352268
C -4.900680 0.604578 -1.070458
C 4.865923 1.689211 -1.027932
H -0.190430 -1.225311 1.513145
H 0.805927 -0.904280 -1.371965
H -1.164519 0.371233 -0.930499
H 0.081276 1.517203 1.644884
H -0.532979 2.450252 0.271913
H -4.225117 -0.762422 1.106301
H 1.194858 1.498275 -1.238039
H 1.955698 2.233737 0.200684
H 2.974877 -0.007453 -1.777083
H -0.815521 -3.196708 0.123684
H -1.383753 -2.131785 -1.180754
H 1.499350 -3.181117 -0.905670
H 1.911247 -2.800868 0.782034
H -3.319398 -2.936291 0.219207
H -2.529358 -2.330414 1.685322
H 4.087102 -2.206292 0.032366
H 3.590388 -2.310057 -1.671542
H -2.606166 2.073641 -0.690381
H -2.918662 2.616844 0.965753
H 2.993293 0.797579 1.964402
H 1.491413 -0.090773 2.316169
H 2.976333 -0.974371 1.877909
H -1.787221 1.385759 2.714182
H -3.419520 0.679693 2.770110
H -1.990328 -0.384432 2.813696
H -4.497498 -1.493708 -1.346126
H -3.146090 -0.426844 -1.762023
H -5.050205 2.636915 -0.362148
H -5.163750 1.402465 0.910243
H 4.006013 2.384283 -0.936558
H 5.014910 1.491611 -2.113065
H 6.416367 1.631538 0.195032


