%chk=000259885.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259885

0 1
O 3.567353 1.319755 -1.843967
O -6.874620 -0.525261 0.200678
O 8.032554 -2.651689 0.823702
C 1.440827 0.688190 -0.895535
C 0.866919 0.910442 0.541295
C 2.982720 0.840925 -0.618963
C -0.663808 0.992059 0.499916
C 1.662251 2.111648 1.080789
C 0.942349 -0.678535 -1.396981
C -1.195925 -0.383316 -0.000280
C 3.069571 1.958564 0.463915
C -0.596703 -0.724973 -1.383782
C 1.030771 1.780131 -1.895715
C -1.279029 1.298484 1.872669
C 3.690843 -0.462783 -0.206369
C -2.709594 -0.415114 0.007678
C -2.795218 1.472867 1.736539
C -3.450412 0.442160 0.856102
C 5.174757 -0.261064 0.125082
C -3.397954 -1.344251 -0.781545
C -4.845845 0.366697 0.883154
C 5.881382 -1.598030 0.365717
C -4.793085 -1.436993 -0.771343
C -5.501927 -0.571031 0.066483
C 7.355425 -1.390632 0.724705
C -7.660082 -1.444993 -0.593721
H 1.139963 0.024197 1.169518
H -0.978469 1.787850 -0.217261
H 1.699178 2.116004 2.180758
H 1.199796 3.066786 0.779009
H 1.339594 -1.499545 -0.773855
H 1.313943 -0.863710 -2.422433
H -0.856832 -1.170669 0.723800
H 3.395275 2.900009 -0.011948
H 3.816842 1.723080 1.236689
H -0.998316 -0.022804 -2.141419
H -0.929597 -1.733032 -1.697232
H 1.557465 1.636997 -2.850342
H -0.044925 1.771781 -2.096042
H 1.300978 2.780215 -1.541367
H -0.833294 2.214999 2.301107
H -1.051145 0.486066 2.588401
H 3.593922 -1.193989 -1.035109
H 3.167780 -0.909418 0.660751
H -3.019436 2.479342 1.319339
H -3.260795 1.459684 2.743925
H 4.542977 1.269284 -1.808561
H 5.670321 0.284135 -0.705714
H 5.274651 0.388190 1.019071
H -2.838348 -2.024137 -1.427756
H -5.439273 1.016169 1.521830
H 5.813958 -2.240506 -0.536365
H 5.369407 -2.163615 1.167394
H -5.292909 -2.164424 -1.398618
H 7.483855 -0.837855 1.671642
H 7.918137 -0.881266 -0.081001
H 7.631235 -3.205891 1.519752
H -7.421376 -2.478105 -0.325936
H -7.506339 -1.253951 -1.659544
H -8.683147 -1.186634 -0.291504


%chk=000259885-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259885

0 1
O 3.693071 1.331849 -1.980662
O -6.939224 -0.699878 0.368921
O 7.823556 -2.884085 1.332047
C 1.481272 0.815785 -0.995325
C 0.906078 0.971442 0.448974
C 3.031833 0.927897 -0.715105
C -0.633439 1.003541 0.481013
C 1.696318 2.164203 1.043553
C 0.955941 -0.515559 -1.587912
C -1.173667 -0.326279 -0.132633
C 3.108745 2.066124 0.373433
C -0.596775 -0.579286 -1.556038
C 1.074039 1.991917 -1.928761
C -1.213107 1.177626 1.901013
C 3.682025 -0.399240 -0.228607
C -2.707059 -0.405589 -0.049773
C -2.741674 1.368454 1.832480
C -3.434754 0.366500 0.910085
C 5.210882 -0.337091 0.006660
C -3.441737 -1.288054 -0.878338
C -4.836036 0.229480 1.005152
C 5.763276 -1.654781 0.600179
C -4.844471 -1.428123 -0.789475
C -5.546853 -0.658103 0.167143
C 7.290100 -1.622072 0.793445
C -7.710950 -1.610159 -0.477681
H 1.203573 0.060450 1.017346
H -0.994603 1.856159 -0.133273
H 1.757268 2.115129 2.145368
H 1.202805 3.120818 0.787782
H 1.341171 -1.370364 -0.996894
H 1.316842 -0.648369 -2.626399
H -0.767946 -1.139271 0.516640
H 3.376810 3.015366 -0.125183
H 3.891420 1.858314 1.125536
H -1.035366 0.149366 -2.264388
H -0.901641 -1.581316 -1.913257
H 1.562504 1.866019 -2.908438
H -0.016621 2.032529 -2.084411
H 1.395093 2.970312 -1.531649
H -0.753836 2.049628 2.404550
H -0.965113 0.282099 2.507970
H 3.488108 -1.183127 -0.984858
H 3.191704 -0.722810 0.711276
H -2.956135 2.393136 1.462478
H -3.187368 1.309188 2.844123
H 4.658890 1.456384 -1.801220
H 5.731582 -0.144724 -0.955518
H 5.468274 0.502704 0.684044
H -2.914496 -1.895050 -1.621911
H -5.402509 0.813899 1.739274
H 5.506043 -2.504906 -0.061010
H 5.271675 -1.849202 1.577817
H -5.362252 -2.125865 -1.454612
H 7.576377 -0.764014 1.441462
H 7.801808 -1.505974 -0.177342
H 7.397181 -3.061097 2.208700
H -7.399285 -2.662975 -0.329383
H -7.614584 -1.345308 -1.549144
H -8.756167 -1.485150 -0.158060


