%chk=000249298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249298

0 1
O 2.191122 0.737189 -0.675200
O 2.016302 1.212847 1.528808
C 0.794767 2.553912 -0.153608
C -0.651806 2.237919 0.268116
C -1.203213 1.004678 -0.458676
C -2.626208 0.672638 0.008641
C -3.184440 -0.553080 -0.727111
C 1.257659 3.918252 0.390362
C -4.606991 -0.887448 -0.259108
C 1.707841 1.467682 0.389451
C 2.206924 -1.606761 -0.041013
C 3.014215 -2.920728 -0.063307
C -5.167567 -2.112705 -0.994960
C 2.611243 4.333750 -0.176187
C 3.066250 -0.398984 -0.397580
C 2.061191 -4.117433 0.056987
C 4.058321 -2.952687 1.059023
C -6.583385 -2.450226 -0.532819
H 0.862388 2.559982 -1.272923
H -0.699523 2.088617 1.366494
H -1.294093 3.115323 0.056462
H -0.537613 0.134444 -0.288875
H -1.194074 1.175117 -1.552974
H -2.630740 0.489050 1.100890
H -3.290709 1.543086 -0.153618
H -2.520541 -1.424065 -0.564295
H -3.180444 -0.371189 -1.819166
H 0.497049 4.685510 0.144142
H 1.307099 3.881556 1.499172
H -5.272340 -0.017498 -0.419481
H -4.612264 -1.071472 0.832510
H 1.357303 -1.672300 -0.749359
H 1.748979 -1.454372 0.957872
H 3.546566 -2.995386 -1.044736
H -5.164970 -1.929492 -2.087294
H -4.504164 -2.984790 -0.833169
H 3.403667 3.628685 0.105297
H 2.909499 5.319745 0.199624
H 2.597604 4.390173 -1.270833
H 3.595631 -0.506605 -1.360383
H 3.767666 -0.121362 0.408331
H 1.333633 -4.137718 -0.760953
H 2.609786 -5.065252 0.031154
H 1.499395 -4.093521 0.997545
H 4.602662 -3.902990 1.070015
H 4.797535 -2.152940 0.949354
H 3.594344 -2.831575 2.045058
H -7.275853 -1.620341 -0.713903
H -6.974861 -3.325653 -1.062820
H -6.615236 -2.674683 0.539441


%chk=000249298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249298

0 1
O 2.293711 0.772344 -0.768018
O 1.946042 1.202819 1.499416
C 0.811805 2.597599 -0.198958
C -0.657390 2.279103 0.208380
C -1.224974 0.994050 -0.433465
C -2.689780 0.716095 -0.027538
C -3.260908 -0.571268 -0.663271
C 1.276641 3.958181 0.390687
C -4.718145 -0.869967 -0.244242
C 1.723035 1.479932 0.296429
C 2.312806 -1.664061 -0.258902
C 3.158722 -2.956612 -0.094120
C -5.285081 -2.159184 -0.881305
C 2.685652 4.386071 -0.071489
C 3.161127 -0.392843 -0.407136
C 2.233818 -4.196834 -0.124951
C 4.004865 -2.941161 1.202710
C -6.739437 -2.454061 -0.454344
H 0.884955 2.629026 -1.302552
H -0.707154 2.200612 1.312755
H -1.286813 3.144210 -0.083242
H -0.599816 0.124678 -0.143611
H -1.155364 1.070526 -1.538338
H -2.753704 0.639138 1.077948
H -3.323909 1.580674 -0.316234
H -2.617110 -1.431968 -0.384587
H -3.207129 -0.489323 -1.769245
H 0.537155 4.727488 0.092866
H 1.247845 3.890190 1.495326
H -5.364873 -0.010990 -0.521390
H -4.772011 -0.954411 0.861481
H 1.672062 -1.761117 -1.157502
H 1.642882 -1.552598 0.616361
H 3.852153 -3.025185 -0.960451
H -5.232842 -2.072788 -1.986016
H -4.636619 -3.016124 -0.606140
H 3.454945 3.667488 0.266346
H 2.951398 5.376391 0.340797
H 2.743623 4.449715 -1.174200
H 3.865207 -0.469361 -1.252955
H 3.700985 -0.149215 0.524064
H 1.649102 -4.241277 -1.062747
H 2.818512 -5.131660 -0.042397
H 1.518750 -4.170295 0.719748
H 4.559410 -3.890609 1.319988
H 4.744497 -2.120010 1.209464
H 3.354236 -2.815754 2.089345
H -7.413557 -1.626685 -0.746604
H -7.120586 -3.381097 -0.921035
H -6.813137 -2.572974 0.643272


