%chk=000271987.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271987

0 1
O 0.628941 0.235627 1.943007
O -0.324586 -2.055693 -0.600679
O -0.499699 -2.247073 1.651615
C 1.065571 0.365317 -0.400148
C 1.324842 1.881657 -0.339001
C 2.375498 -0.419461 -0.197878
C 2.383015 2.300959 -1.366644
C 3.433665 0.003545 -1.224137
C 3.688105 1.516381 -1.173576
C 0.020406 -0.041434 0.677880
C -0.290980 -1.569334 0.673920
C -1.249861 0.648223 0.549536
C -2.297649 1.238512 0.454060
C -3.561822 1.945881 0.343101
C -0.594029 -3.484321 -0.788191
C -4.730224 0.950017 0.377550
C -3.583920 2.791629 -0.938505
C 0.656557 -4.283451 -0.490077
H 0.629210 0.099692 -1.396105
H 1.656074 2.151957 0.685046
H 0.385176 2.437733 -0.512895
H 2.184956 -1.506134 -0.281493
H 2.749735 -0.245956 0.832349
H 2.578806 3.385867 -1.278423
H 1.997245 2.140607 -2.391547
H 3.108190 -0.287984 -2.241197
H 4.375934 -0.543581 -1.034301
H 4.421877 1.803730 -1.948428
H 4.143961 1.785206 -0.200923
H 0.055093 -0.080236 2.684689
H -3.654597 2.636592 1.228833
H -1.445275 -3.767713 -0.144314
H -0.881203 -3.499827 -1.855267
H -4.691915 0.252494 -0.467831
H -4.718208 0.350330 1.295575
H -5.693206 1.470013 0.331764
H -2.756707 3.510900 -0.957551
H -4.518904 3.356212 -1.022104
H -3.494746 2.167542 -1.835947
H 0.526962 -5.342023 -0.744292
H 1.521190 -3.907164 -1.051838
H 0.915722 -4.231041 0.578767


%chk=000271987-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271987

0 1
O 0.650169 0.344264 2.077935
O -0.463345 -2.002908 -0.512133
O -0.191949 -2.210761 1.793961
C 1.151766 0.424222 -0.319000
C 1.423794 1.947951 -0.267046
C 2.467461 -0.374090 -0.143482
C 2.475514 2.362795 -1.322654
C 3.520056 0.041665 -1.198880
C 3.790184 1.564081 -1.156739
C 0.091368 0.014746 0.756307
C -0.186739 -1.518630 0.745387
C -1.213902 0.684901 0.551917
C -2.306724 1.241605 0.410258
C -3.619539 1.901774 0.242958
C -0.798939 -3.463148 -0.615650
C -4.779192 0.872668 0.353322
C -3.686491 2.684533 -1.098066
C 0.473686 -4.307215 -0.711565
H 0.710662 0.174201 -1.305491
H 1.783646 2.208201 0.746804
H 0.479558 2.502026 -0.428556
H 2.271097 -1.462120 -0.226552
H 2.859033 -0.188701 0.874699
H 2.675118 3.449334 -1.244218
H 2.067752 2.185114 -2.340214
H 3.154416 -0.233594 -2.210521
H 4.459665 -0.520716 -1.033428
H 4.514526 1.847175 -1.945398
H 4.253050 1.824908 -0.182634
H 0.324794 -0.352337 2.713283
H -3.732187 2.633214 1.070468
H -1.405201 -3.741201 0.264218
H -1.406627 -3.516371 -1.532501
H -4.714241 0.128707 -0.460912
H -4.743088 0.333869 1.316058
H -5.753780 1.388675 0.276443
H -2.881271 3.436979 -1.160800
H -4.658764 3.203036 -1.186372
H -3.580676 1.994630 -1.954421
H 0.201852 -5.365536 -0.881632
H 1.105904 -3.975315 -1.553197
H 1.056785 -4.248432 0.222443


