%chk=000231419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231419

0 1
O -4.199839 0.105929 -0.716082
C 1.742460 1.169169 0.112635
C 2.828036 0.043541 0.321644
C 2.174700 -1.291635 -0.165242
C 0.442982 0.376510 0.045527
C 0.690324 -1.008664 -0.121267
C 1.915121 1.942990 -1.201510
C 1.751277 2.140686 1.299633
C 4.166319 0.307830 -0.355109
C 2.584587 -2.487407 0.688709
C -0.855015 0.848799 0.104029
C -0.356932 -1.906136 -0.239527
C -1.931376 -0.057503 -0.010696
C -1.686962 -1.430411 -0.193078
C -2.808737 -2.405747 -0.320942
C -3.326020 0.472958 0.041466
C -3.608536 1.501914 1.104009
H 3.009215 -0.043541 1.420764
H 2.465235 -1.484567 -1.227691
H 1.072499 2.621654 -1.374348
H 2.827534 2.547145 -1.199772
H 1.962987 1.263343 -2.059932
H 2.736972 2.600632 1.427798
H 1.028470 2.951382 1.160908
H 1.494876 1.633774 2.236590
H 4.894311 -0.472068 -0.101849
H 4.084813 0.331223 -1.447818
H 4.589053 1.267946 -0.037203
H 2.232700 -2.387770 1.722694
H 2.169484 -3.421589 0.293313
H 3.674656 -2.597227 0.719171
H -1.048322 1.912957 0.229049
H -0.165248 -2.967880 -0.370928
H -2.486571 -3.385819 -0.691540
H -3.311292 -2.567580 0.642982
H -3.583070 -2.034785 -1.019907
H -3.296331 2.502735 0.778497
H -3.092334 1.282919 2.046231
H -4.686728 1.560893 1.313192


%chk=000231419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231419

0 1
O -4.414574 -0.368875 0.316480
C 1.716839 1.164338 0.186738
C 2.788876 0.018078 0.385595
C 2.177631 -1.250386 -0.302727
C 0.418203 0.346957 0.154110
C 0.678746 -1.014610 -0.143382
C 1.882682 1.899389 -1.176775
C 1.764402 2.195437 1.337836
C 4.221341 0.351793 -0.064412
C 2.693784 -2.588711 0.264298
C -0.903371 0.778699 0.322992
C -0.384821 -1.926866 -0.264153
C -1.997823 -0.133462 0.210108
C -1.734560 -1.518338 -0.091270
C -2.821337 -2.567677 -0.232882
C -3.392767 0.380491 0.407440
C -3.598589 1.864717 0.731228
H 2.805957 -0.197465 1.476752
H 2.425178 -1.215254 -1.388060
H 1.041292 2.598425 -1.337724
H 2.819958 2.484933 -1.202684
H 1.893608 1.189122 -2.023749
H 2.754566 2.687010 1.381509
H 1.008283 2.991493 1.199638
H 1.576928 1.712141 2.314216
H 4.913798 -0.474069 0.182454
H 4.275164 0.518337 -1.155929
H 4.603503 1.260688 0.436837
H 2.456418 -2.675047 1.340852
H 2.238576 -3.452554 -0.254182
H 3.789506 -2.672323 0.145437
H -1.102276 1.830421 0.552920
H -0.183281 -2.981114 -0.489740
H -2.373435 -3.551679 -0.458441
H -3.431036 -2.649792 0.683664
H -3.539041 -2.305537 -1.029453
H -3.202729 2.514171 -0.071348
H -3.091459 2.147915 1.672207
H -4.678843 2.045804 0.837998


