%chk=000245309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245309

0 1
O 2.991846 -0.417405 0.262551
O -3.145841 -1.124801 0.892496
O -3.087513 0.814320 -0.370621
O 1.171678 2.339825 -1.941861
O 2.987586 1.617863 -1.021310
N 1.787768 1.561467 -1.224300
C -1.138841 -0.524862 -0.137858
C -2.637095 -0.546708 -0.317767
C -0.384235 0.486354 -0.721923
C 1.018260 0.497344 -0.580696
C 1.647193 -0.516697 0.189930
C -0.507463 -1.520324 0.638539
C 0.870326 -1.525734 0.800629
C 3.748837 -1.411707 1.048335
C 5.177582 -0.976312 0.806176
C -4.579418 -1.129883 1.022793
C -4.018353 1.123503 -1.425086
H -2.978195 -1.132737 -1.193189
H -0.871039 1.291182 -1.292840
H -1.125295 -2.286659 1.121010
H 1.340109 -2.297630 1.402863
H 3.437012 -1.314685 2.101914
H 3.522764 -2.416039 0.655788
H 5.846301 -1.301183 1.610505
H 5.570711 -1.353570 -0.146811
H 5.237931 0.126278 0.742933
H -5.036881 -1.720161 0.225537
H -4.953550 -0.100145 1.036565
H -4.725935 -1.605358 2.000766
H -3.542320 0.996906 -2.402071
H -4.237706 2.184608 -1.240668
H -4.926626 0.522452 -1.339727


%chk=000245309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245309

0 1
O 3.103394 -0.384245 0.225161
O -3.190663 -1.053250 1.017340
O -3.135695 0.914223 -0.400993
O 1.142945 2.168446 -2.327396
O 2.872648 2.073464 -0.846635
N 1.735739 1.661062 -1.289724
C -1.139210 -0.421007 -0.027726
C -2.651860 -0.448233 -0.188886
C -0.377345 0.556125 -0.691851
C 1.028922 0.574686 -0.577677
C 1.719799 -0.412429 0.193672
C -0.468159 -1.395093 0.750481
C 0.934504 -1.394791 0.856654
C 3.817795 -1.438645 0.988102
C 5.305796 -1.145642 0.827270
C -4.649765 -1.196411 1.009181
C -4.112924 1.073695 -1.488834
H -2.958482 -1.068298 -1.070038
H -0.865610 1.334547 -1.281863
H -1.059803 -2.142947 1.285487
H 1.421261 -2.164625 1.460659
H 3.506752 -1.389990 2.050901
H 3.549066 -2.433032 0.577365
H 5.899141 -1.892866 1.385042
H 5.599039 -1.184391 -0.235092
H 5.546109 -0.141949 1.215203
H -4.997639 -1.732194 0.099541
H -5.142732 -0.208732 1.071138
H -4.899553 -1.789179 1.902248
H -3.698835 0.732648 -2.458920
H -4.316187 2.154360 -1.541602
H -5.058850 0.534195 -1.285604


