%chk=000179324.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179324

0 1
F 0.758649 2.535362 0.785548
O -0.567976 -2.181931 0.537936
O -1.125185 2.284251 -0.592567
O 4.079250 -1.541511 -0.753087
N -0.449934 0.108515 -0.001362
N 5.184895 0.801171 0.223975
C -2.588876 -0.825600 0.140861
C -2.754886 0.470376 -0.194756
C -3.687020 -1.801689 0.335711
C -4.062620 1.134949 -0.404928
C -5.033492 -1.063143 0.469046
C -5.175537 0.078631 -0.551834
C -1.118388 -1.146464 0.277099
C -1.413880 1.156149 -0.312829
C 0.969287 0.298827 0.031833
C 1.831817 -0.752853 -0.332814
C 1.546529 1.524245 0.425685
C 3.206872 -0.555980 -0.295573
C 2.924894 1.739057 0.450869
C 3.786919 0.684362 0.102557
C 4.248894 -2.645841 0.176510
H -3.712477 -2.506923 -0.524486
H -3.500055 -2.434116 1.229586
H -4.276181 1.810145 0.453618
H -4.032398 1.795517 -1.297566
H -5.864873 -1.782146 0.345483
H -5.128390 -0.655563 1.494933
H -6.163615 0.562640 -0.437835
H -5.153069 -0.337957 -1.578169
H 1.429876 -1.722760 -0.639857
H 3.325274 2.704647 0.757645
H 5.566303 1.729623 0.111986
H 5.716735 0.096953 -0.280019
H 4.687079 -2.282074 1.110071
H 4.940254 -3.299687 -0.366295
H 3.290827 -3.142884 0.353626


%chk=000179324-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179324

0 1
F 0.635248 2.504533 1.177592
O -0.604502 -1.817238 1.566203
O -0.972242 1.825852 -1.402460
O 4.346594 -1.373296 -0.411996
N -0.383529 0.084294 0.130046
N 5.212938 0.973959 0.499557
C -2.555294 -0.742941 0.466794
C -2.664062 0.323569 -0.380179
C -3.709679 -1.564768 0.965150
C -3.951746 0.828860 -0.964238
C -5.044415 -0.824749 0.676418
C -5.075036 -0.222641 -0.754312
C -1.107979 -0.939767 0.822859
C -1.292978 0.881467 -0.645067
C 1.023527 0.307740 0.224435
C 1.954770 -0.686701 -0.173728
C 1.535147 1.517990 0.729962
C 3.333116 -0.454932 -0.063962
C 2.908334 1.786464 0.825067
C 3.839719 0.795094 0.428598
C 3.920102 -2.685600 -0.898128
H -3.700996 -2.556206 0.467113
H -3.591982 -1.773534 2.045384
H -4.221944 1.788884 -0.478194
H -3.818267 1.067438 -2.036511
H -5.892950 -1.520326 0.812353
H -5.173221 -0.008096 1.414098
H -6.059854 0.240739 -0.948333
H -4.950566 -1.039801 -1.492479
H 1.568278 -1.635726 -0.552699
H 3.240555 2.752464 1.216495
H 5.615536 1.838942 0.844816
H 5.819667 0.214252 0.202478
H 3.311011 -3.211825 -0.138099
H 4.848552 -3.244900 -1.085248
H 3.343653 -2.593197 -1.839183


