%chk=000180465.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180465

0 1
O -4.314251 2.097123 0.229863
O -1.538739 2.679324 0.006773
O -5.143635 -0.187909 -0.259524
O -3.308930 -2.572380 -0.113931
C -3.297633 1.143459 0.539034
C -2.084233 1.415611 -0.397060
C -3.876347 -0.283403 0.419241
C -1.047565 0.318511 -0.285831
C -3.034641 -1.211989 -0.486355
C -1.554506 -0.983342 -0.292839
C 0.359280 0.525640 -0.208808
C 1.216516 -0.597461 -0.047843
C -0.698168 -2.094828 -0.151038
C 0.660408 -1.901152 -0.014756
C 2.657963 -0.404680 0.074883
C 0.963617 1.838630 -0.314651
C 3.194983 0.900447 -0.004715
C 2.303944 2.018548 -0.217106
C 3.548704 -1.493938 0.275981
C 4.596314 1.098734 0.117726
C 4.908961 -1.285774 0.393443
C 5.439273 0.023000 0.313975
H -3.023965 1.394871 1.591791
H -2.415136 1.519798 -1.459480
H -4.026656 -0.750141 1.417718
H -3.324586 -1.072617 -1.557270
H -1.132327 -3.099207 -0.141694
H 1.321829 -2.761004 0.112911
H 0.308456 2.701629 -0.486515
H -4.764762 1.853284 -0.622279
H -2.273760 3.337017 0.097983
H -5.820223 0.188504 0.351477
H -4.238056 -2.793705 -0.349900
H 2.743901 3.012229 -0.298931
H 3.144538 -2.505808 0.339292
H 4.994799 2.110219 0.055616
H 5.584638 -2.125081 0.548667
H 6.513797 0.169739 0.409250


%chk=000180465-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180465

0 1
O -4.280251 2.214326 0.278804
O -1.669824 2.791713 -0.427529
O -5.240135 -0.227776 -0.031159
O -3.437002 -2.547233 -0.338918
C -3.245428 1.196843 0.505993
C -2.113780 1.407060 -0.546959
C -3.837048 -0.249752 0.464852
C -1.036448 0.339377 -0.357792
C -3.064072 -1.146462 -0.523613
C -1.566530 -0.973606 -0.338742
C 0.383026 0.539530 -0.219663
C 1.242838 -0.615960 -0.041997
C -0.721605 -2.097532 -0.166898
C 0.656080 -1.916231 -0.018199
C 2.692895 -0.431460 0.100432
C 0.990345 1.857653 -0.266107
C 3.242662 0.899546 0.049836
C 2.355362 2.021957 -0.139915
C 3.600816 -1.520169 0.289812
C 4.652077 1.095939 0.184504
C 4.980472 -1.308715 0.420776
C 5.515815 0.010398 0.367778
H -2.821764 1.415629 1.500258
H -2.575070 1.269020 -1.555577
H -3.798188 -0.717765 1.465282
H -3.358645 -0.815555 -1.547358
H -1.171201 -3.093102 -0.154595
H 1.286057 -2.800227 0.111992
H 0.332707 2.716416 -0.401291
H -4.986863 1.776066 -0.273830
H -2.504422 3.329599 -0.345516
H -5.861792 -0.182225 0.737469
H -4.406831 -2.620316 -0.528648
H 2.791502 3.027512 -0.181901
H 3.225802 -2.546743 0.336960
H 5.046525 2.118208 0.141236
H 5.650853 -2.163303 0.564997
H 6.594868 0.169241 0.470323


