%chk=000191283.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191283

0 1
O 5.298671 1.573452 -0.289650
O -4.489987 1.824394 -0.146753
O -5.317756 -0.339593 0.373715
C 2.555711 -0.632586 -0.363339
C 3.054798 0.712699 0.249913
C 1.106410 -0.891108 0.059196
C 0.237891 0.241517 -0.566776
C 2.244887 1.849934 -0.381789
C 3.661712 -1.644395 -0.007023
C 0.742710 1.634343 -0.122591
C 0.576997 -2.249456 -0.417702
C 4.557776 0.645918 -0.092975
C 4.963722 -0.825802 -0.133573
C -1.231990 0.022911 -0.268763
C 2.991835 0.782005 1.782667
C -0.840240 -2.470103 0.121561
C -1.727479 -1.256932 0.022353
C -2.110677 1.138150 -0.358345
C -3.112674 -1.482010 0.263115
C -3.443417 0.907765 -0.124463
C -3.941266 -0.390861 0.186213
C -5.699901 1.060471 0.167356
H 2.565039 -0.528219 -1.481035
H 1.021787 -0.845493 1.171381
H 0.343714 0.182289 -1.683623
H 2.445893 1.908978 -1.468124
H 2.564367 2.827257 0.028995
H 3.658030 -2.512168 -0.684549
H 3.535075 -2.042296 1.013623
H 0.526814 1.776844 0.954778
H 0.172227 2.422891 -0.652295
H 1.240250 -3.065935 -0.077235
H 0.577475 -2.299673 -1.523354
H 5.499880 -1.045431 -1.074049
H 5.680957 -1.049795 0.674482
H 3.509397 -0.057250 2.259217
H 3.447037 1.710207 2.150643
H 1.953978 0.766249 2.139319
H -0.789264 -2.780175 1.188395
H -1.307435 -3.322432 -0.414941
H -1.742829 2.131807 -0.605291
H -3.492498 -2.472699 0.494836
H -6.361872 1.102994 -0.707241
H -6.103158 1.441937 1.114323


%chk=000191283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191283

0 1
O 5.355615 1.609953 -0.329927
O -4.575680 1.842547 -0.169984
O -5.421055 -0.361680 0.300007
C 2.580152 -0.647596 -0.304374
C 3.098989 0.711657 0.256426
C 1.111055 -0.906274 0.072560
C 0.246871 0.250166 -0.528105
C 2.278897 1.863799 -0.357881
C 3.694521 -1.662055 0.068610
C 0.761924 1.656281 -0.092357
C 0.568871 -2.259220 -0.431327
C 4.590024 0.638031 -0.124157
C 4.995977 -0.853312 -0.207671
C -1.253492 0.026358 -0.262488
C 3.086564 0.796370 1.817294
C -0.849006 -2.500281 0.123710
C -1.761887 -1.279452 0.011172
C -2.157947 1.131640 -0.340260
C -3.159195 -1.489335 0.214892
C -3.515022 0.897009 -0.135970
C -4.010961 -0.390929 0.138899
C -5.807975 1.065477 0.128459
H 2.608771 -0.551256 -1.416255
H 1.007726 -0.894018 1.179138
H 0.396886 0.191994 -1.632496
H 2.461022 1.895376 -1.451284
H 2.606663 2.839624 0.046435
H 3.645705 -2.587103 -0.531189
H 3.626156 -1.955538 1.133090
H 0.531468 1.812524 0.979806
H 0.213681 2.443347 -0.642962
H 1.233986 -3.086691 -0.118954
H 0.552197 -2.255115 -1.540665
H 5.384189 -1.041541 -1.227553
H 5.827745 -1.066039 0.487850
H 3.643666 -0.031891 2.290518
H 3.558618 1.744167 2.132543
H 2.058042 0.777965 2.213911
H -0.769840 -2.787621 1.193580
H -1.320748 -3.361177 -0.388563
H -1.806312 2.142843 -0.554360
H -3.547983 -2.490818 0.423315
H -6.501260 1.148687 -0.726229
H -6.245019 1.433727 1.073397


