%chk=000276591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276591

0 1
O 4.875055 1.290667 0.017181
O -4.306666 1.625727 -1.061210
C -0.128400 0.100399 0.580611
C 2.616803 0.519464 -0.556079
C 2.045428 -0.909852 -0.280493
C -1.659762 -0.161575 0.788169
C 0.542740 -0.921940 -0.308390
C 0.269348 1.457910 -0.042590
C 1.785371 1.654912 0.085972
C 2.660992 -1.356299 1.067519
C -2.315268 -0.782595 -0.439195
C -2.359158 1.151278 1.214357
C 3.981647 0.498656 0.177748
C 4.027554 -0.665872 1.151044
C 2.820643 0.756854 -2.049211
C -1.797127 -1.208022 1.921440
C -0.152642 -1.663725 -1.188713
C -3.809282 -0.710108 -0.579712
C -3.882333 1.038910 1.269669
C -4.455110 0.589673 -0.080169
C -1.596462 -1.513562 -1.314036
H 0.336609 0.052025 1.600944
H 2.433698 -1.596330 -1.074860
H -0.251612 2.297148 0.454919
H -0.038824 1.490800 -1.105410
H 2.077123 2.621631 -0.370926
H 2.045244 1.746852 1.160164
H 2.748160 -2.453421 1.119430
H 2.016095 -1.056496 1.914007
H -2.092437 1.967461 0.511226
H -1.973338 1.469368 2.201865
H 4.855058 -1.348614 0.880104
H 4.263457 -0.314940 2.171395
H 3.415148 -0.034954 -2.518433
H 1.858755 0.803243 -2.574287
H 3.349995 1.702443 -2.232304
H -2.845893 -1.467545 2.098568
H -1.269805 -2.134300 1.663529
H -1.387387 -0.839965 2.866200
H 0.323692 -2.378269 -1.855959
H -4.104634 -0.854041 -1.642371
H -4.250979 -1.570544 -0.031735
H -4.192991 0.332049 2.061631
H -4.319111 2.020143 1.543233
H -5.565333 0.488910 -0.033109
H -2.058418 -2.012201 -2.164362
H -3.361942 1.777246 -1.265172


%chk=000276591-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276591

0 1
O 4.980915 1.282742 -0.186576
O -4.216102 1.635772 -1.206045
C -0.150692 0.104693 0.632300
C 2.651135 0.492284 -0.550233
C 2.072374 -0.928179 -0.195071
C -1.701153 -0.157633 0.797465
C 0.560567 -0.930920 -0.237323
C 0.315232 1.490168 0.074209
C 1.853781 1.616208 0.204930
C 2.748984 -1.289916 1.168366
C -2.349251 -0.758731 -0.465779
C -2.435253 1.157525 1.213247
C 4.067901 0.461058 0.069453
C 4.182549 -0.721382 1.045217
C 2.700779 0.781637 -2.063495
C -1.859382 -1.229641 1.927886
C -0.137778 -1.613233 -1.198646
C -3.870050 -0.747648 -0.567340
C -3.975518 1.050988 1.211241
C -4.493479 0.611118 -0.176533
C -1.584501 -1.457530 -1.362068
H 0.260416 0.056126 1.664863
H 2.449313 -1.641792 -0.957054
H -0.140760 2.319116 0.645570
H -0.002899 1.602008 -0.980919
H 2.198790 2.595473 -0.176882
H 2.105777 1.598308 1.285808
H 2.733025 -2.378165 1.348381
H 2.217132 -0.810208 2.010124
H -2.167266 1.969832 0.511725
H -2.076093 1.474918 2.212158
H 4.869378 -1.460976 0.585206
H 4.647576 -0.408036 1.995983
H 3.206022 -0.036298 -2.609873
H 1.684443 0.889799 -2.481888
H 3.265428 1.712033 -2.251528
H -2.911985 -1.529319 2.073752
H -1.279648 -2.136954 1.679177
H -1.483094 -0.829870 2.889641
H 0.398252 -2.271783 -1.894846
H -4.185453 -1.027057 -1.589794
H -4.291233 -1.515103 0.117189
H -4.329717 0.328237 1.972899
H -4.414760 2.033482 1.464229
H -5.595185 0.539209 -0.168840
H -2.066829 -1.948434 -2.217927
H -3.277987 1.524670 -1.510160


