%chk=000223050.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223050

0 1
O 3.270493 0.590930 -1.108033
O 2.865929 -2.846721 0.499483
O 0.551731 3.185580 0.912605
O -0.377228 -3.216452 1.024288
O 1.487239 2.844895 -1.123883
O -0.017799 -2.651219 -1.144795
O -3.968471 0.128076 -1.789847
O -4.863311 1.051029 0.205451
C 1.583462 1.099392 0.594402
C 0.682498 -0.008924 0.001191
C 3.081057 0.771011 0.297636
C 0.999360 -1.357406 0.687483
C 3.467544 -0.587431 0.896164
C 2.489788 -1.710248 0.644190
C -0.794688 0.304586 0.128920
C 3.998835 1.887189 0.796161
C 1.216941 2.436518 -0.015611
C 0.180563 -2.458217 0.028262
C -1.619906 0.015869 -0.992662
C -1.329749 0.836589 1.301856
C -2.956078 0.305039 -0.855682
C -2.706971 1.131377 1.438524
C -3.496106 0.858566 0.345421
C -0.002555 4.479660 0.492760
C -1.147421 -4.402972 0.635789
C -5.201227 0.585823 -1.144448
C -1.274995 4.247801 -0.290695
C -0.203604 -5.503418 0.203721
H 1.439626 1.153745 1.703805
H 0.950296 -0.111845 -1.092638
H 0.708880 -1.305301 1.774322
H 4.453113 -0.888928 0.457692
H 3.650170 -0.503033 1.986385
H 5.052364 1.637560 0.604605
H 3.816963 2.833996 0.270170
H 3.892953 2.077871 1.868223
H 2.975707 1.389688 -1.621786
H -1.212574 -0.430067 -1.901831
H -0.677959 1.056380 2.148386
H -3.109925 1.545515 2.357888
H -0.170645 4.956809 1.475363
H 0.767808 5.019598 -0.085211
H -1.858637 -4.110952 -0.156867
H -1.674846 -4.621344 1.581972
H -5.871719 -0.277912 -1.044783
H -5.579989 1.446167 -1.711355
H -1.941466 3.538947 0.222999
H -1.065238 3.823928 -1.284520
H -1.831926 5.179959 -0.441980
H -0.726528 -6.456431 0.068353
H 0.289122 -5.255677 -0.750071
H 0.599018 -5.658498 0.938127


%chk=000223050-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223050

0 1
O 3.269472 0.470375 -1.068847
O 2.888829 -2.873007 0.349126
O 0.541891 3.277607 0.716699
O -0.168929 -3.502714 1.129700
O 1.432852 2.613675 -1.330587
O -0.171872 -2.697150 -1.063870
O -3.994474 1.050987 -1.822447
O -4.971983 1.310501 0.352420
C 1.503698 1.067284 0.584668
C 0.585730 -0.075226 0.035028
C 3.023692 0.735115 0.359967
C 0.943266 -1.422041 0.735627
C 3.381983 -0.593934 1.061526
C 2.458067 -1.738280 0.663349
C -0.898516 0.267399 0.184624
C 3.936314 1.875490 0.858682
C 1.160398 2.372381 -0.120770
C 0.145741 -2.579359 0.139415
C -1.687734 0.448975 -0.988161
C -1.488176 0.423026 1.465208
C -3.031268 0.782840 -0.814386
C -2.857346 0.763083 1.629633
C -3.607134 0.936861 0.464169
C 0.097144 4.581283 0.111870
C -0.815202 -4.775039 0.671019
C -5.285695 1.168911 -1.095890
C -1.306377 4.441014 -0.480447
C 0.245732 -5.768874 0.191514
H 1.319615 1.206152 1.665709
H 0.815781 -0.201161 -1.038194
H 0.695649 -1.355820 1.814798
H 4.415092 -0.875623 0.798066
H 3.326217 -0.456079 2.160364
H 4.991507 1.589289 0.709098
H 3.758077 2.805420 0.289137
H 3.775879 2.089620 1.931637
H 2.864663 1.222521 -1.589355
H -1.255808 0.316080 -1.983496
H -0.879010 0.283190 2.365800
H -3.306098 0.884191 2.618703
H 0.124306 5.277082 0.965130
H 0.835679 4.879042 -0.652717
H -1.533679 -4.529789 -0.131036
H -1.348887 -5.130062 1.567012
H -5.871492 0.242394 -1.247772
H -5.809941 2.073464 -1.439320
H -2.018274 4.069634 0.276359
H -1.307137 3.747337 -1.337360
H -1.656631 5.428434 -0.834246
H -0.237474 -6.726978 -0.076745
H 0.770931 -5.381113 -0.696400
H 0.990832 -5.961313 0.981887


