%chk=000289705.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289705

0 1
S 3.655248 2.024152 -0.194995
N -4.456541 -2.054543 0.133011
N 2.820597 -0.481197 0.040032
N 1.054017 1.222063 -0.168440
N 0.022930 0.332173 -0.074939
C -3.669354 0.282531 0.021564
C -2.311887 -0.198708 -0.051145
C -4.710780 -0.685886 0.112743
C 4.870209 0.776450 -0.044271
C 4.241199 -0.495976 0.072103
C -4.031066 1.665021 0.010124
C -2.083857 -1.558981 -0.028866
C -6.079732 -0.263234 0.188479
C 2.359851 0.739518 -0.092063
C -5.346798 2.048444 0.084067
C -1.205262 0.773986 -0.152979
C -6.383552 1.073073 0.174153
C 6.252299 0.908637 -0.029743
C 5.021912 -1.653083 0.205915
C -3.192436 -2.458556 0.065406
C 7.019541 -0.252447 0.104031
C 6.409572 -1.513686 0.220079
H -3.240091 2.412852 -0.058093
H -1.069689 -1.964901 -0.078226
H -6.851197 -1.032887 0.256933
H -1.510014 1.824275 -0.288697
H -5.621942 3.102286 0.075690
H 6.728265 1.883719 -0.119223
H 4.540975 -2.626956 0.295469
H -7.417824 1.411658 0.231323
H -3.011212 -3.541830 0.084090
H 8.106286 -0.180538 0.118892
H 7.036066 -2.400674 0.323316
H 0.909970 2.231345 -0.294139


%chk=000289705-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289705

0 1
S 3.688879 2.136655 -0.121375
N -4.503541 -2.065012 0.159777
N 2.852666 -0.449203 0.044073
N 1.072711 1.192107 -0.055878
N 0.046892 0.280019 0.005783
C -3.694759 0.300571 0.036735
C -2.324121 -0.175120 0.044035
C -4.749570 -0.698507 0.096480
C 4.916764 0.796241 -0.038343
C 4.261189 -0.479024 0.043914
C -4.075826 1.682091 -0.023941
C -2.105801 -1.566074 0.109542
C -6.120392 -0.282509 0.092310
C 2.396829 0.776008 -0.032837
C -5.421521 2.058585 -0.025949
C -1.187790 0.751064 -0.015405
C -6.454381 1.070744 0.032414
C 6.317916 0.910799 -0.047854
C 5.043733 -1.655247 0.118117
C -3.211178 -2.458186 0.165240
C 7.082157 -0.278006 0.027121
C 6.449226 -1.546037 0.109213
H -3.312745 2.466301 -0.068876
H -1.081259 -1.947747 0.116030
H -6.879840 -1.068862 0.138393
H -1.390771 1.835980 -0.078349
H -5.690253 3.119754 -0.072521
H 6.811842 1.884992 -0.111080
H 4.540778 -2.624408 0.181157
H -7.504623 1.381691 0.030042
H -3.038493 -3.539619 0.215841
H 8.175311 -0.213399 0.021437
H 7.061427 -2.452284 0.166532
H 0.884246 2.203741 -0.120177


