%chk=000261993.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261993

0 1
O -4.434299 0.949348 -1.032618
O -3.407423 -0.133218 1.779454
O -3.735244 -1.067903 -1.708157
O -2.533438 1.920661 1.618494
O 3.918156 2.097183 0.357800
C -0.020915 -0.681005 0.570027
C -1.396101 -0.940833 -0.096388
C -2.268318 0.313627 -0.259676
C -1.522826 1.408836 -1.047059
C 0.635139 0.603166 0.064928
C -0.086456 1.584593 -0.643026
C 0.825897 -1.910692 0.225704
C -0.175340 -0.507333 2.094047
C -3.515182 -0.071980 -1.068969
C -2.709064 0.846893 1.105147
C 1.979202 0.826850 0.377203
C 0.550274 2.777296 -1.021094
C 1.547806 -1.949933 -0.978941
C 0.847431 -3.031667 1.067234
C 2.593983 2.027549 -0.018325
C 1.891379 3.015617 -0.719636
C 2.294208 -3.079256 -1.321476
C 1.595447 -4.162106 0.722132
C 2.322606 -4.188947 -0.470381
C 4.651394 3.300521 0.026398
H -1.240825 -1.392518 -1.102895
H -1.948727 -1.712504 0.481970
H -2.072732 2.372387 -0.931415
H -1.551738 1.167829 -2.133819
H -0.896416 -1.212380 2.520043
H 0.783237 -0.653001 2.608479
H -0.508845 0.506493 2.354209
H 2.564448 0.085506 0.921570
H -0.011189 3.541386 -1.560693
H 1.534050 -1.092655 -1.652781
H 0.280275 -3.037234 1.996537
H 2.360271 3.945307 -1.020953
H 2.854988 -3.094884 -2.254659
H 1.607735 -5.024470 1.386582
H -5.265415 0.739955 -1.541467
H -3.733819 0.173411 2.668118
H 2.905447 -5.067845 -0.737144
H 4.202453 4.167764 0.518918
H 4.703984 3.427403 -1.058452
H 5.642404 3.080585 0.444929


%chk=000261993-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261993

0 1
O -4.506828 0.953181 -1.037857
O -3.526908 -0.061580 1.765420
O -3.702682 -1.098080 -1.761772
O -2.581321 2.043722 1.522558
O 3.999002 2.131365 0.422011
C -0.021587 -0.702571 0.584212
C -1.403405 -0.933764 -0.112042
C -2.295960 0.330939 -0.272932
C -1.523938 1.416777 -1.075974
C 0.648647 0.595647 0.075899
C -0.080003 1.599380 -0.623726
C 0.835988 -1.949025 0.237728
C -0.201207 -0.550513 2.126397
C -3.543790 -0.061850 -1.088123
C -2.781196 0.900397 1.068990
C 2.004416 0.828319 0.399493
C 0.577561 2.804285 -0.965099
C 1.392320 -2.076847 -1.063976
C 1.030922 -3.015370 1.150503
C 2.648458 2.032781 0.043037
C 1.929803 3.041420 -0.645516
C 2.123631 -3.222659 -1.438340
C 1.763437 -4.168081 0.779870
C 2.313183 -4.278597 -0.515521
C 4.705690 3.365691 0.076473
H -1.235458 -1.322906 -1.132242
H -1.958418 -1.714786 0.435486
H -2.066613 2.375268 -1.007764
H -1.532164 1.113374 -2.143428
H -0.845269 -1.347538 2.539398
H 0.777632 -0.586471 2.636162
H -0.655162 0.423065 2.372670
H 2.588956 0.066769 0.926006
H 0.013670 3.583705 -1.492639
H 1.264514 -1.259348 -1.783775
H 0.618649 -2.957485 2.162585
H 2.397534 3.989522 -0.926209
H 2.547310 -3.292326 -2.446763
H 1.903119 -4.977596 1.505674
H -5.297347 0.693253 -1.583969
H -3.854972 0.330088 2.619120
H 2.882192 -5.170042 -0.802532
H 4.240880 4.247002 0.560720
H 4.737031 3.520430 -1.020131
H 5.727585 3.228859 0.459819


