%chk=000116929.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116929

0 1
O -1.107060 2.325492 -0.372997
O -3.305501 1.036917 -0.321818
O -3.414129 -1.170360 -0.077755
O 3.659671 -1.023753 0.209559
O 3.605510 1.126047 -0.024608
N -1.083456 -2.532589 0.178232
N 3.072762 0.036011 0.069651
C -1.246390 -0.105365 -0.103489
C -0.477199 -1.309150 0.066338
C -0.532013 1.120891 -0.211135
C 1.567452 -0.013441 0.009271
C 0.945186 -1.244081 0.121135
C 0.873278 1.179532 -0.156090
C -2.688777 -0.197050 -0.155991
H 1.539227 -2.151741 0.249303
H 1.384778 2.142557 -0.242309
H -2.099474 -2.637084 0.145693
H -0.542458 -3.373887 0.297343
H -2.121038 2.322134 -0.417203
H -4.296869 0.970918 -0.357531


%chk=000116929-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116929

0 1
O -1.154347 2.370863 -0.380213
O -3.332286 1.080877 -0.326060
O -3.410415 -1.214596 -0.074052
O 3.695270 -1.089892 0.226628
O 3.647645 1.172411 -0.034114
N -1.100822 -2.542557 0.177364
N 3.067978 0.027107 0.071031
C -1.233185 -0.096831 -0.104677
C -0.471761 -1.323649 0.067025
C -0.520780 1.157722 -0.215108
C 1.575312 -0.012079 0.009250
C 0.949000 -1.260225 0.122403
C 0.885800 1.202079 -0.158256
C -2.687888 -0.180641 -0.157753
H 1.554255 -2.160850 0.250943
H 1.413107 2.152623 -0.242383
H -2.125073 -2.580954 0.137727
H -0.549362 -3.388674 0.297647
H -2.153050 2.237420 -0.408422
H -4.315899 0.951843 -0.353379


