%chk=000231383.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231383

0 1
O 3.333312 -0.698521 -0.000112
O -3.333353 -0.698462 -0.000408
O 0.000003 1.892088 -0.000541
O 2.875603 1.544949 -0.000969
O -2.875605 1.545001 -0.000459
N 1.181262 -0.123100 -0.000169
N -1.181293 -0.123079 -0.000136
C 4.780662 -0.398005 -0.000367
C -4.780698 -0.397919 -0.000687
C 5.418799 -1.767888 0.000018
C -5.418860 -1.767791 -0.000852
C -0.000008 0.693947 -0.000331
C 2.500687 0.403856 -0.000459
C -2.500709 0.403900 -0.000243
H 4.996248 0.194820 -0.906268
H 4.996433 0.195415 0.905100
H -4.996543 0.195181 0.904972
H -4.996189 0.195234 -0.906397
H 6.514022 -1.693250 -0.000091
H 5.121745 -2.352363 0.882276
H 5.121605 -2.352926 -0.881818
H -6.514081 -1.693132 -0.001115
H -5.121534 -2.352543 -0.882834
H -5.121958 -2.352562 0.881260
H 1.110477 -1.148385 0.000211
H -1.110526 -1.148365 0.000016


%chk=000231383-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231383

0 1
O 3.304243 -0.728126 -0.000132
O -3.304286 -0.728068 -0.000719
O 0.000005 2.023458 -0.000488
O 2.908670 1.594446 -0.000719
O -2.908669 1.594496 -0.000559
N 1.163512 -0.039242 -0.000107
N -1.163538 -0.039222 -0.000382
C 4.774959 -0.462809 -0.000253
C -4.774998 -0.462724 -0.000734
C 5.467386 -1.821005 -0.000007
C -5.467449 -1.820907 -0.000663
C -0.000006 0.781169 -0.000052
C 2.492947 0.423693 -0.000444
C -2.492966 0.423735 -0.000726
H 5.017912 0.137124 -0.895660
H 5.017994 0.137488 0.894887
H -5.017985 0.137445 0.894505
H -5.017975 0.137347 -0.896042
H 6.563150 -1.677764 -0.000082
H 5.195093 -2.404592 0.895896
H 5.195016 -2.404954 -0.895650
H -6.563211 -1.677646 -0.000686
H -5.195117 -2.404732 -0.896399
H -5.195140 -2.404627 0.895148
H 1.079266 -1.058951 0.000126
H -1.079309 -1.058933 -0.000461


