%chk=000272818.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272818

0 1
O -2.041200 -0.169178 -1.615164
O 2.921300 -1.042194 1.075176
O 5.640643 1.173447 0.287351
O 1.652497 1.452606 -1.932779
O -1.245445 -0.083951 0.537771
O 3.858907 -3.087019 0.823627
N 2.629832 2.633307 -0.243705
N 4.140818 0.049040 -1.034607
N -0.921420 1.683971 -0.972005
C 3.972158 2.510156 -0.838537
C 0.181145 2.283354 -0.196130
C -4.164333 -0.989072 -0.767500
C 4.661355 1.195398 -0.435087
C 1.531689 2.054328 -0.875816
C -2.819571 -1.375101 -1.310908
C 4.611752 -1.272587 -0.605068
C -4.304022 -0.678972 0.593802
C -5.280820 -0.940050 -1.613852
C -1.365338 0.411637 -0.566262
C 3.778033 -1.929718 0.485087
C -5.556637 -0.332349 1.105091
C -6.532928 -0.594606 -1.096638
C -6.672308 -0.292512 0.261643
C 2.094221 -1.533840 2.187528
C 0.867847 -2.230066 1.645717
H 3.907913 2.582495 -1.953768
H 4.610099 3.360652 -0.497476
H -0.026825 3.378531 -0.103079
H 0.183471 1.869632 0.846615
H 2.590671 2.986387 0.707295
H -2.859945 -1.844673 -2.312730
H -2.240447 -2.009731 -0.613092
H 4.648106 -1.960459 -1.485999
H 5.667803 -1.193627 -0.219452
H 3.242674 0.076417 -1.534240
H -0.881104 1.859994 -1.984959
H -3.426730 -0.698480 1.247106
H -5.176084 -1.165559 -2.673962
H -5.663452 -0.091801 2.161711
H -7.399919 -0.558595 -1.754168
H -7.648415 -0.024120 0.662373
H 1.867488 -0.585510 2.706548
H 2.716814 -2.191936 2.820168
H 0.257950 -1.557921 1.019085
H 1.136521 -3.102683 1.035053
H 0.218634 -2.582942 2.456640


%chk=000272818-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272818

0 1
O -2.062343 -0.931586 -0.454777
O 3.085974 -1.134712 0.691146
O 5.830883 1.786384 0.306388
O 1.775931 1.213986 -1.827316
O -1.826510 0.496016 1.420027
O 4.562747 -2.933317 0.486406
N 2.571882 2.684631 -0.216039
N 4.463334 0.432318 -1.028836
N -0.542428 0.753352 -0.521883
C 3.903547 2.812791 -0.843028
C 0.253616 1.860942 -0.013338
C -4.536495 -0.942679 -0.103113
C 4.835718 1.636094 -0.464617
C 1.595923 1.884504 -0.755393
C -3.218746 -1.610933 0.225768
C 5.100934 -0.817858 -0.637318
C -5.022173 0.119029 0.704074
C -5.301884 -1.369074 -1.218349
C -1.503891 0.150601 0.248897
C 4.242516 -1.751715 0.225607
C -6.250738 0.744131 0.396857
C -6.530849 -0.744130 -1.526715
C -7.008075 0.313999 -0.718149
C 2.178944 -1.977009 1.541425
C 1.214242 -2.785691 0.671207
H 3.763948 2.853565 -1.937669
H 4.377433 3.743445 -0.496967
H -0.258993 2.834683 -0.164617
H 0.397152 1.742312 1.077081
H 2.429030 3.104192 0.704726
H -3.166108 -2.635861 -0.173713
H -3.020305 -1.606684 1.311400
H 5.425355 -1.402353 -1.517394
H 6.008665 -0.563149 -0.057998
H 3.590535 0.413399 -1.577677
H -0.298068 0.381934 -1.444884
H -4.422334 0.455893 1.556838
H -4.932339 -2.189537 -1.846007
H -6.618483 1.562698 1.025631
H -7.115603 -1.081862 -2.389664
H -7.962881 0.797365 -0.954399
H 1.653302 -1.237323 2.166244
H 2.805711 -2.633798 2.169741
H 0.620621 -2.127603 0.014073
H 1.761451 -3.517355 0.053434
H 0.513247 -3.341936 1.321296


