%chk=000212583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212583

0 1
O 1.009376 -0.249863 3.137697
O -0.795804 0.871318 1.053798
O -3.251016 -0.127159 0.346767
N 3.063247 -0.151123 0.096656
C 2.716909 -0.269493 1.546469
C 4.479366 0.310564 -0.085779
C 2.807669 -1.440037 -0.629650
C 1.187468 -0.166012 1.710915
C 4.556601 1.826137 0.171598
C 2.613923 -1.140188 -2.127043
C 0.630081 1.168342 1.191622
C 5.966546 2.355693 -0.069661
C 2.202729 -2.392894 -2.893202
C -1.539182 1.648757 0.206238
C -2.780122 1.077232 -0.183522
C -1.187526 2.919492 -0.259611
C -3.655623 1.773313 -1.014683
C -2.074794 3.611406 -1.094109
C -3.296843 3.049771 -1.467599
C -2.519680 -1.290742 0.123412
C -1.483024 -1.421541 -0.806903
C -2.969128 -2.368523 0.908534
C -0.882615 -2.675726 -0.948721
C -2.351859 -3.605739 0.741014
C -1.308931 -3.763788 -0.183478
H 3.065723 -1.210848 2.024554
H 3.197755 0.554408 2.121895
H 4.787836 0.101966 -1.134748
H 5.198579 -0.229993 0.564907
H 1.878468 -1.902859 -0.227137
H 3.615623 -2.187315 -0.484902
H 0.645181 -1.017925 1.234506
H 3.832462 2.348350 -0.485363
H 4.237799 2.054206 1.208103
H 1.847594 -0.347359 -2.247480
H 3.544614 -0.718703 -2.555321
H 1.066748 1.440929 0.213530
H 0.732362 1.987863 1.920031
H 6.700135 1.876263 0.588638
H 6.292714 2.188684 -1.102697
H 6.018831 3.434901 0.116726
H 2.941439 -3.195681 -2.793847
H 1.235269 -2.785289 -2.534665
H 2.090066 -2.182367 -3.963034
H 0.052082 -0.219037 3.354813
H -0.246223 3.377781 0.029992
H -4.605321 1.318280 -1.295785
H -1.802564 4.604523 -1.451716
H -3.977382 3.599999 -2.114374
H -1.149875 -0.573833 -1.399037
H -3.777472 -2.219483 1.619888
H -0.066589 -2.800425 -1.673066
H -2.681903 -4.457302 1.335832
H -0.836317 -4.734733 -0.303801


%chk=000212583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212583

0 1
O 0.898921 -0.525128 2.702165
O -0.707463 0.579187 0.660898
O -3.418870 0.116171 0.945313
N 3.529395 -0.237191 0.052255
C 2.906441 -0.270785 1.399908
C 4.758025 0.598846 -0.002988
C 3.720512 -1.594075 -0.530545
C 1.373245 -0.381660 1.319896
C 4.462769 2.114081 -0.045887
C 3.654370 -1.604728 -2.072935
C 0.747490 0.848044 0.658588
C 5.755403 2.958249 -0.073001
C 3.900454 -3.013271 -2.656089
C -1.569098 1.559152 0.165106
C -2.962703 1.275892 0.270043
C -1.154837 2.782456 -0.413624
C -3.915136 2.208191 -0.176829
C -2.119089 3.712507 -0.867607
C -3.497755 3.433600 -0.748315
C -3.185813 -1.168324 0.389600
C -2.777244 -1.376457 -0.946959
C -3.444428 -2.256661 1.252627
C -2.622275 -2.700764 -1.415478
C -3.285873 -3.572594 0.768899
C -2.872924 -3.802844 -0.565731
H 3.274844 -1.117582 2.023775
H 3.157250 0.656603 1.946362
H 5.313812 0.327981 -0.920452
H 5.442457 0.379372 0.855982
H 2.920273 -2.252609 -0.142135
H 4.687807 -2.047490 -0.195849
H 1.082362 -1.274234 0.724977
H 3.845596 2.323635 -0.940758
H 3.854286 2.404041 0.833913
H 2.661071 -1.226925 -2.381942
H 4.400427 -0.897498 -2.486012
H 1.128964 0.965555 -0.372691
H 0.951809 1.760919 1.254362
H 6.372117 2.771941 0.826523
H 6.372571 2.716058 -0.958906
H 5.527286 4.038869 -0.107241
H 4.900925 -3.393357 -2.374620
H 3.150456 -3.736240 -2.283147
H 3.840818 -3.005534 -3.759414
H -0.093382 -0.519164 2.676285
H -0.089986 3.016212 -0.503432
H -4.974993 1.960602 -0.062311
H -1.785192 4.657344 -1.309772
H -4.242839 4.157074 -1.093797
H -2.587842 -0.524704 -1.607963
H -3.764881 -2.056112 2.279497
H -2.307356 -2.868058 -2.451813
H -3.485038 -4.418654 1.436080
H -2.751735 -4.825741 -0.937612


