%chk=000297643.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297643

0 1
O 1.912757 0.328021 -1.168188
O 1.912756 0.327783 1.168110
C 3.928541 -0.472404 -0.000123
C 3.350456 0.237290 -1.250623
C 3.350454 0.237027 1.250525
C 1.443471 1.022589 0.000031
C 3.508431 -1.945602 -0.000280
C 5.456445 -0.343315 -0.000108
C -0.056915 0.880095 0.000012
C -0.642430 -0.364376 0.000105
C -0.859879 2.061713 -0.000105
C -2.067184 -0.490805 0.000088
C -2.866882 0.681726 -0.000029
C -2.227763 1.963228 -0.000125
C -2.705256 -1.772007 0.000186
C -4.292449 0.553622 -0.000048
C -4.074402 -1.865890 0.000164
C -4.877779 -0.687780 0.000046
H 3.765778 1.248942 -1.388515
H 3.490637 -0.351600 -2.174287
H 3.490633 -0.352059 2.174064
H 3.765780 1.248648 1.388632
H 1.829210 2.060748 0.000139
H 3.874180 -2.476633 -0.883990
H 3.874157 -2.476815 0.883330
H 2.409421 -2.018651 -0.000303
H 5.787282 0.700306 0.000003
H 5.896676 -0.827164 0.879796
H 5.896678 -0.826978 -0.880113
H -0.020329 -1.261835 0.000198
H -0.372101 3.035190 -0.000181
H -2.850681 2.856313 -0.000216
H -2.081732 -2.665097 0.000277
H -4.898355 1.458047 -0.000139
H -4.568493 -2.835858 0.000238
H -5.961414 -0.794520 0.000031


%chk=000297643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297643

0 1
O 1.914990 0.172030 -1.207115
O 1.914971 0.171697 1.206997
C 4.019962 -0.467345 -0.000137
C 3.391827 0.219222 -1.244142
C 3.391807 0.218860 1.244058
C 1.416924 0.843551 0.000033
C 3.699068 -1.980174 -0.000360
C 5.547120 -0.228051 -0.000088
C -0.090057 0.788226 0.000015
C -0.745898 -0.446195 0.000150
C -0.851405 1.999748 -0.000157
C -2.174852 -0.519046 0.000122
C -2.945061 0.710192 -0.000055
C -2.246705 1.961987 -0.000193
C -2.871560 -1.773914 0.000267
C -4.377742 0.634699 -0.000082
C -4.267174 -1.816507 0.000238
C -5.027067 -0.601685 0.000062
H 3.724120 1.281976 -1.296769
H 3.676772 -0.294517 -2.177541
H 3.676733 -0.295158 2.177310
H 3.724110 1.281595 1.297008
H 1.800225 1.894367 0.000173
H 4.125250 -2.471546 -0.895402
H 4.125212 -2.471802 0.894561
H 2.608520 -2.144153 -0.000408
H 5.794168 0.851357 0.000083
H 6.016113 -0.683804 0.892230
H 6.016124 -0.683522 -0.892545
H -0.157581 -1.370047 0.000298
H -0.326275 2.962699 -0.000264
H -2.826029 2.892959 -0.000325
H -2.287846 -2.702375 0.000403
H -4.957444 1.565895 -0.000216
H -4.789837 -2.779452 0.000352
H -6.121784 -0.649871 0.000041


