%chk=000186365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186365

0 1
O -3.332094 -1.848428 0.377465
O -1.997717 4.113791 -0.463409
O -3.838849 -0.170634 -1.056460
C -2.610664 0.273566 1.050047
C -1.251880 0.693469 0.532370
C -3.481433 1.471975 1.466362
C -0.167425 -0.210993 0.564311
C -1.064255 1.991283 0.026182
C 1.112777 0.218667 0.109934
C -3.555129 2.514459 0.356580
C 1.291884 1.540092 -0.386143
C 2.242420 -0.683112 0.150273
C -2.182875 2.984498 -0.060585
C 0.194201 2.408007 -0.425333
C -0.296030 -1.579288 1.040376
C 2.079536 -2.008541 0.638754
C -3.324501 -0.533568 -0.028574
C 3.521423 -0.248024 -0.297648
C 2.608133 1.954860 -0.840301
C 0.760076 -2.425759 1.078608
C 3.664680 1.109047 -0.797706
C 3.185418 -2.872815 0.678154
C 4.608382 -1.135455 -0.246485
C 4.436066 -2.433807 0.238613
C -3.886407 -2.854482 -0.531693
C -2.880248 -3.160874 -1.619809
H -2.471618 -0.384767 1.954384
H -3.056758 1.923892 2.387036
H -4.500013 1.129675 1.737445
H -4.179352 3.379869 0.657691
H -4.062591 2.087446 -0.545480
H 0.304487 3.428680 -0.810683
H -1.288209 -1.918302 1.356857
H 2.710903 2.973822 -1.216149
H 0.649959 -3.448766 1.438717
H 4.653019 1.419013 -1.137098
H 3.067512 -3.888137 1.052649
H 5.590229 -0.809936 -0.586512
H 5.288389 -3.112790 0.273988
H -4.051033 -3.696447 0.164734
H -4.845216 -2.476862 -0.929030
H -3.180502 -4.032614 -2.212957
H -2.770337 -2.313170 -2.313602
H -1.883856 -3.364139 -1.204674


%chk=000186365-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186365

0 1
O -3.552643 -1.888760 0.373087
O -1.962029 4.204049 -0.427554
O -3.643075 -0.185445 -1.218945
C -2.593976 0.232878 1.002408
C -1.213091 0.696922 0.525857
C -3.492366 1.430038 1.426561
C -0.096256 -0.199869 0.554906
C -1.026886 2.029633 0.052785
C 1.205132 0.261202 0.124966
C -3.547755 2.530529 0.350020
C 1.372172 1.618040 -0.340867
C 2.340669 -0.619994 0.155434
C -2.158116 3.016624 -0.032962
C 0.249925 2.472142 -0.368800
C -0.212684 -1.576578 1.000984
C 2.191916 -1.978417 0.615342
C -3.299461 -0.591732 -0.085582
C 3.637260 -0.150830 -0.274625
C 2.681960 2.064254 -0.769433
C 0.881600 -2.421989 1.032326
C 3.770895 1.215035 -0.736851
C 3.325494 -2.835454 0.641347
C 4.744414 -1.039901 -0.233444
C 4.587908 -2.367499 0.220809
C -4.230020 -2.819472 -0.589125
C -3.204350 -3.488090 -1.507766
H -2.479162 -0.431713 1.875074
H -3.075739 1.846731 2.363833
H -4.511215 1.067332 1.657136
H -4.142578 3.399446 0.680336
H -4.021855 2.130829 -0.568061
H 0.337807 3.505742 -0.721697
H -1.189900 -1.962171 1.304373
H 2.787578 3.096848 -1.120678
H 0.767009 -3.456905 1.376006
H 4.758791 1.561528 -1.061690
H 3.208957 -3.867622 0.991430
H 5.728303 -0.683381 -0.559751
H 5.453166 -3.038672 0.245737
H -4.737139 -3.543098 0.068739
H -4.972177 -2.241549 -1.167258
H -3.712038 -4.230145 -2.151515
H -2.716711 -2.744347 -2.159687
H -2.429231 -4.011770 -0.922007


