%chk=000290099.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290099

0 1
O 1.702232 -1.208669 -2.756652
O -0.169773 0.954656 -2.157860
O 0.498669 3.511753 -1.921627
N -3.785469 -0.603799 0.468412
C 0.038108 -0.985610 0.241284
C 1.019117 -1.796356 1.158493
C 0.016974 -1.675311 -1.141661
C -1.392493 -1.051303 0.840525
C 2.424382 -1.939241 0.529128
C 0.466536 0.478494 0.194776
C 2.392635 -2.540337 -0.879898
C 1.179229 -1.112779 2.492661
C 1.407481 -1.764144 -1.716776
C 0.956784 1.064301 1.395649
C -2.401956 -0.163076 0.090998
C 1.149979 0.223616 2.585765
C 0.340148 1.314942 -0.915692
C 1.274551 2.428094 1.460633
C 0.656019 2.698579 -0.834639
C 1.124216 3.263460 0.351870
C -4.261467 -1.698421 -0.429896
C -4.737907 0.545843 0.427188
H 0.585280 -2.814087 1.306749
H -0.672486 -1.128159 -1.826665
H -0.422078 -2.688430 -1.051046
H -1.371640 -0.742504 1.905924
H -1.745283 -2.100179 0.858299
H 3.060892 -2.563551 1.185175
H 2.913735 -0.942405 0.493728
H 2.111259 -3.611120 -0.849376
H 3.403461 -2.508201 -1.337099
H 1.336083 -1.760307 3.349808
H -2.213794 -0.187907 -1.005764
H -2.247169 0.895906 0.394380
H 1.272167 0.740728 3.536974
H 1.646729 2.851945 2.394323
H 1.361599 4.324129 0.394786
H -4.387793 -1.410241 -1.483818
H -5.229006 -2.068911 -0.054882
H -3.552171 -2.538955 -0.383915
H -4.416826 1.300537 1.163559
H -5.735462 0.197547 0.738829
H -4.833749 1.034997 -0.552974
H 0.488503 0.356634 -2.644862
H 0.119752 2.984743 -2.693516


%chk=000290099-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290099

0 1
O 1.939336 -0.809812 -2.740112
O 0.214479 1.147107 -2.265298
O 0.599701 3.681814 -1.746145
N -3.766901 -0.295251 0.497433
C 0.071029 -1.004350 0.090989
C 1.014990 -1.867312 1.005780
C 0.127851 -1.640579 -1.345476
C -1.403565 -1.135898 0.615527
C 2.463791 -1.975708 0.433099
C 0.497084 0.484832 0.167374
C 2.514432 -2.484504 -1.049782
C 1.088460 -1.294585 2.412729
C 1.557675 -1.622831 -1.836017
C 0.821314 0.987155 1.479676
C -2.468991 -0.389524 -0.215341
C 1.000971 0.053689 2.601082
C 0.476570 1.415846 -0.896914
C 1.012455 2.376112 1.691083
C 0.667985 2.815410 -0.659150
C 0.922452 3.302025 0.633687
C -4.433185 -1.601479 0.670804
C -4.665103 0.693878 -0.134264
H 0.579869 -2.889079 1.040545
H -0.538652 -1.112735 -2.042396
H -0.215572 -2.688251 -1.245597
H -1.453983 -0.745186 1.647379
H -1.638945 -2.219039 0.662195
H 3.060321 -2.657793 1.066326
H 2.943740 -0.980869 0.487058
H 2.184898 -3.541161 -1.083232
H 3.535788 -2.409454 -1.457995
H 1.274940 -1.975624 3.251107
H -2.597337 -0.875309 -1.218949
H -2.117073 0.641751 -0.399644
H 1.107235 0.484866 3.604653
H 1.247098 2.731121 2.701140
H 1.062699 4.375538 0.785710
H -4.668933 -2.107625 -0.302304
H -5.381339 -1.459867 1.219640
H -3.800527 -2.281165 1.266750
H -4.164611 1.677467 -0.172748
H -5.583682 0.800168 0.470579
H -4.969174 0.419180 -1.177216
H 0.841846 0.436342 -2.648086
H 0.408564 3.107594 -2.544379


