%chk=000298794.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298794

0 1
O 5.442396 -0.957448 1.789205
O -5.442058 0.955870 1.789854
O 6.821489 0.325902 0.345059
O -6.821053 -0.326278 0.344548
N 0.765991 -1.123010 -1.058963
N -0.765535 1.124131 -1.057848
N -0.586309 -1.268247 -0.736792
N 0.586774 1.269032 -0.735507
C 2.783641 0.256422 -0.486667
C -2.783180 -0.255923 -0.486982
C 4.669704 -0.365133 0.800343
C -4.669309 0.364442 0.800503
C 5.501389 0.409125 -0.069149
C -5.500935 -0.409092 -0.069687
C 3.311137 -0.462185 0.621953
C -3.310742 0.461702 0.622246
C 1.329827 0.186689 -0.744441
C -1.329370 -0.185899 -0.744650
C 3.591614 1.017149 -1.332198
C -3.591095 -1.015949 -1.333194
C 4.990206 1.108829 -1.137875
C -4.989689 -1.107852 -1.138997
C 6.823236 -0.535652 1.532248
C -6.822870 0.534235 1.532492
H 2.678000 -1.034517 1.293662
H -2.677654 1.033467 1.294479
H 3.139372 1.562214 -2.165415
H -3.138805 -1.560275 -2.166867
H 5.616791 1.702242 -1.798875
H -5.616229 -1.700715 -1.800534
H 7.411396 -1.432444 1.296580
H 7.155786 0.068732 2.386662
H -7.411066 1.431206 1.297595
H -7.155414 -0.070913 2.386367
H 1.299687 -1.932972 -0.703489
H -1.299223 1.933715 -0.701467


%chk=000298794-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298794

0 1
O 5.752123 -1.662286 0.822352
O -5.751700 1.661574 0.823677
O 6.859507 0.459942 0.595107
O -6.859092 -0.460438 0.594462
N 0.774989 -1.010994 -1.119969
N -0.774512 1.012015 -1.119093
N -0.578117 -1.307834 -0.678955
N 0.578576 1.308461 -0.677763
C 2.775361 0.313152 -0.375127
C -2.774915 -0.312794 -0.375515
C 4.846069 -0.674603 0.363284
C -4.845637 0.674302 0.363741
C 5.496337 0.570692 0.235581
C -5.495911 -0.570871 0.234879
C 3.493484 -0.841530 0.071327
C -3.493042 0.841484 0.071977
C 1.341579 0.223763 -0.728813
C -1.341119 -0.223091 -0.729065
C 3.439622 1.564519 -0.500743
C -3.439184 -1.564039 -0.502300
C 4.813607 1.714015 -0.192521
C -4.813179 -1.713805 -0.194255
C 7.054429 -0.962613 0.991724
C -7.054007 0.961748 0.992402
H 3.010108 -1.810035 0.228473
H -3.009664 1.809841 0.230030
H 2.857533 2.423588 -0.844723
H -2.857093 -2.422797 -0.847050
H 5.320621 2.676887 -0.290179
H -5.320199 -2.676583 -0.292811
H 7.799841 -1.422301 0.320699
H 7.348375 -1.001138 2.054772
H -7.799418 1.422062 0.321806
H -7.347950 0.999285 2.055486
H 1.355238 -1.848902 -1.120143
H -1.354759 1.849924 -1.118557


