%chk=000282918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282918

0 1
O 4.492016 -2.652564 1.462841
N 3.763991 -0.524692 1.413658
N -4.836943 -0.015304 -0.508758
C 0.828782 1.289986 -0.342613
C 1.756628 0.269836 -1.053655
C 3.234839 0.625956 -0.750093
C -0.651021 1.069917 -0.789088
C 3.580793 0.798733 0.759164
C 1.059899 1.184958 1.174684
C 2.492221 1.599892 1.519735
C 1.343156 -1.171763 -0.709170
C 4.236734 -0.325702 -1.428559
C -1.050806 -0.396781 -0.683550
C -1.606313 1.925891 0.080251
C -0.138343 -1.384084 -0.698012
C -0.781945 1.492166 -2.269544
C 4.917841 1.571744 0.896781
C 4.439993 -1.664504 -0.719773
C -3.079208 1.716197 -0.285708
C -2.479969 -0.692231 -0.597947
C 4.258663 -1.661887 0.780066
C -3.431985 0.252315 -0.414624
C -5.282772 -1.447558 -0.525222
C -5.738231 0.682989 0.467829
C -5.965551 -1.743815 0.825680
C -6.265631 -0.374167 1.460464
H 1.117198 2.320060 -0.665603
H 1.616612 0.394833 -2.160038
H 3.390751 1.638207 -1.214207
H 0.861486 0.149449 1.517592
H 0.347095 1.824949 1.728667
H 2.622028 2.677283 1.292983
H 2.651013 1.514016 2.611866
H 1.725992 -1.453069 0.296518
H 1.817644 -1.874751 -1.422995
H 5.215295 0.191695 -1.509314
H 3.916260 -0.514141 -2.472962
H -1.347418 2.995621 -0.016744
H -1.459313 1.663638 1.148093
H -0.437367 -2.430073 -0.657428
H 3.625859 -0.571512 2.423189
H -0.619678 2.563992 -2.403519
H -0.061059 0.955492 -2.898541
H -1.778996 1.251206 -2.658281
H 4.875253 2.550329 0.411467
H 5.180172 1.735677 1.947471
H 5.750360 1.016554 0.449423
H 5.451662 -2.067006 -0.943120
H 3.737874 -2.427568 -1.128755
H -3.311945 2.216552 -1.251106
H -3.720246 2.215839 0.472615
H -2.747701 -1.746512 -0.687483
H -4.446810 -2.147473 -0.730223
H -6.002527 -1.544585 -1.366411
H -6.570947 1.121655 -0.123167
H -5.227709 1.519328 0.986995
H -5.306088 -2.342217 1.477536
H -6.884940 -2.334620 0.684531
H -7.344396 -0.241984 1.643123
H -5.768254 -0.279090 2.440592


%chk=000282918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282918

0 1
O 5.035726 -2.519699 1.316691
N 4.093724 -0.407803 1.205586
N -4.756070 -0.254742 0.221866
C 0.874231 1.215802 -0.216800
C 1.770970 0.217510 -1.012041
C 3.275472 0.637393 -0.909312
C -0.651484 0.965762 -0.495278
C 3.807234 0.895131 0.539011
C 1.310478 1.191540 1.269851
C 2.770589 1.675511 1.395254
C 1.435041 -1.250401 -0.627868
C 4.252691 -0.299553 -1.673169
C -1.009909 -0.523315 -0.364837
C -1.548181 1.755548 0.504539
C -0.049138 -1.497870 -0.464405
C -0.976596 1.453107 -1.943166
C 5.125431 1.726604 0.501211
C 4.638478 -1.598083 -0.914453
C -3.055921 1.559333 0.232615
C -2.420649 -0.855515 -0.163053
C 4.627717 -1.539718 0.616292
C -3.410005 0.083859 0.085788
C -5.235727 -1.649591 0.128449
C -5.859878 0.701337 0.461415
C -6.738811 -1.559539 0.489339
C -7.123125 -0.111180 0.091165
H 1.093898 2.241361 -0.596528
H 1.519804 0.320523 -2.088017
H 3.327344 1.628352 -1.410425
H 1.191387 0.174600 1.688930
H 0.677791 1.863588 1.877754
H 2.814689 2.737858 1.080682
H 3.098688 1.654646 2.456092
H 1.953747 -1.540225 0.308373
H 1.833773 -1.929858 -1.408884
H 5.175131 0.267547 -1.899404
H 3.811840 -0.564688 -2.653677
H -1.299002 2.835745 0.461469
H -1.342140 1.406780 1.533333
H -0.356919 -2.550651 -0.371104
H 4.106007 -0.415339 2.231617
H -0.884141 2.555288 -2.012817
H -0.290266 1.002028 -2.680199
H -1.999567 1.168705 -2.244246
H 4.974837 2.684089 -0.031151
H 5.459729 1.955828 1.530577
H 5.939145 1.172435 0.002685
H 5.647142 -1.940740 -1.209436
H 3.958724 -2.429652 -1.174770
H -3.359125 2.116157 -0.678379
H -3.632573 2.003316 1.067837
H -2.683001 -1.919140 -0.218588
H -4.680428 -2.308168 0.826367
H -5.076243 -2.047774 -0.897093
H -5.752148 1.608294 -0.161006
H -5.902027 1.026258 1.525254
H -6.876691 -1.702122 1.577086
H -7.340014 -2.322879 -0.032713
H -7.302947 -0.050873 -0.998032
H -8.024733 0.254587 0.611323


