%chk=000230164.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230164

0 1
O -2.918933 0.665377 -0.145914
O -2.906222 -1.635297 0.277529
C -5.070644 -0.463033 0.144972
C -4.260627 0.850496 0.378570
C -4.822094 2.109435 -0.331335
C -4.251955 -1.614311 0.790748
C -2.186269 -0.403900 0.468199
C -6.429690 -0.368415 0.850866
C -5.249790 -0.755095 -1.346848
C -0.907709 -0.550879 -0.351483
C -4.039933 2.445348 -1.603764
C -4.814338 3.303123 0.633155
C 0.349241 -0.363608 0.501142
C 1.620207 -0.515731 -0.345779
C 2.884261 -0.328875 0.504014
C 4.155134 -0.481169 -0.342701
C 5.419941 -0.295531 0.506442
C 6.689773 -0.447234 -0.341295
C 7.956131 -0.262927 0.507800
C 9.201280 -0.405923 -0.317190
C 10.259454 0.394339 -0.202569
H -4.163273 1.030298 1.473517
H -5.884956 1.900700 -0.616154
H -4.628695 -2.610916 0.501567
H -4.214761 -1.538086 1.889711
H -2.068711 -0.208417 1.550094
H -6.329552 -0.164779 1.921640
H -6.999757 -1.298249 0.743048
H -7.044995 0.432227 0.422512
H -5.759780 -1.707431 -1.518536
H -4.261341 -0.815682 -1.830596
H -5.822614 0.025638 -1.855603
H -0.932991 0.183576 -1.186055
H -0.909807 -1.550299 -0.839493
H -4.471017 3.301335 -2.128388
H -4.015043 1.590906 -2.290747
H -2.991307 2.677101 -1.370529
H -5.211977 4.201829 0.148305
H -5.422619 3.114371 1.522719
H -3.796653 3.541882 0.964886
H 0.358745 -1.101934 1.327148
H 0.335048 0.635390 0.979994
H 1.610675 0.219202 -1.174073
H 1.633902 -1.512616 -0.827870
H 2.870363 0.667981 0.985559
H 2.893481 -1.063918 1.331916
H 4.146174 0.254275 -1.170385
H 4.168368 -1.477456 -0.825511
H 5.428926 -1.030939 1.333958
H 5.405840 0.700935 0.988929
H 6.701644 -1.441681 -0.827788
H 6.685153 0.292642 -1.165630
H 7.926441 0.721914 1.016720
H 7.979785 -1.015526 1.324685
H 9.189492 -1.236643 -1.025770
H 11.157748 0.274486 -0.789544
H 10.313546 1.228194 0.481007


%chk=000230164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230164

0 1
O -2.733605 0.218732 -0.107070
O -3.400904 -2.095135 -0.181952
C -5.181494 -0.312106 -0.126423
C -4.061492 0.657711 0.391900
C -4.193988 2.174899 0.076415
C -4.743513 -1.741363 0.312528
C -2.415858 -1.139971 0.328797
C -6.522939 -0.002153 0.584257
C -5.360110 -0.274489 -1.661634
C -1.049497 -1.523957 -0.223629
C -3.574179 2.591450 -1.281517
C -3.550449 3.004439 1.217001
C 0.101192 -0.668461 0.349300
C 1.479022 -1.083602 -0.212521
C 2.648794 -0.256585 0.366087
C 4.027771 -0.682248 -0.186903
C 5.202230 0.129603 0.404009
C 6.579836 -0.307822 -0.142268
C 7.755631 0.505948 0.462672
C 9.108993 0.030905 -0.022274
C 10.027709 0.792264 -0.668968
H -4.054998 0.540598 1.504704
H -5.277659 2.410007 0.052159
H -5.420107 -2.507045 -0.103465
H -4.754394 -1.811192 1.425335
H -2.451602 -1.164291 1.448396
H -6.402716 0.044504 1.684204
H -7.269721 -0.787306 0.358920
H -6.946559 0.960462 0.247003
H -6.070714 -1.060526 -1.980931
H -4.398018 -0.453473 -2.170095
H -5.765885 0.696968 -1.995361
H -1.090784 -1.427106 -1.324834
H -0.884824 -2.593840 0.006418
H -3.740160 3.672251 -1.448553
H -4.006105 2.041607 -2.132906
H -2.488062 2.400336 -1.279023
H -3.616471 4.087491 1.004692
H -4.046862 2.816906 2.187913
H -2.481002 2.742451 1.321274
H 0.116520 -0.759353 1.456058
H -0.093153 0.397473 0.122842
H 1.469474 -0.982423 -1.317867
H 1.653243 -2.159758 -0.001107
H 2.481179 0.818880 0.148331
H 2.652836 -0.352501 1.472300
H 4.028438 -0.577278 -1.291965
H 4.187554 -1.760968 0.021990
H 5.197837 0.028669 1.509899
H 5.048116 1.207959 0.190263
H 6.734071 -1.386217 0.070727
H 6.596255 -0.202035 -1.245432
H 7.626870 1.580177 0.225746
H 7.707655 0.414420 1.569249
H 9.338417 -1.029956 0.171358
H 10.988641 0.380904 -0.998661
H 9.842238 1.851644 -0.887586


