%chk=000245230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245230

0 1
O -4.031216 -0.953260 -0.590191
O 5.835871 0.220647 -0.033205
C 0.162490 -0.484423 -0.353440
C 1.644131 -0.401244 0.144477
C -0.700290 0.657951 0.256960
C 2.200958 1.001123 -0.261683
C -2.144883 0.546923 -0.279337
C -2.755003 -0.829423 0.101250
C -0.092433 2.031888 -0.086831
C -0.461960 -1.864594 -0.063543
C 1.369097 2.133344 0.361567
C 2.495742 -1.472945 -0.593459
C -1.918542 -1.960169 -0.526708
C 3.686938 1.147605 0.099762
C -3.093533 1.668065 0.175482
C 1.726931 -0.629515 1.661720
C 3.992149 -1.356081 -0.287373
C 4.511664 0.057028 -0.592484
C -2.970637 -1.044614 1.601636
C -4.460451 1.478685 -0.498143
C -5.002734 0.062775 -0.274171
H 0.171550 -0.343429 -1.462428
H -0.712880 0.545103 1.367175
H 2.111311 1.086413 -1.374921
H -2.102749 0.581586 -1.399171
H -0.682828 2.834555 0.394852
H -0.165399 2.216110 -1.175845
H -0.404163 -2.084873 1.021026
H 0.129584 -2.655842 -0.563197
H 1.784339 3.115375 0.066693
H 1.436209 2.098620 1.465293
H 2.332021 -1.389246 -1.684663
H 2.146365 -2.485274 -0.314112
H -1.992352 -1.899025 -1.629882
H -2.350302 -2.942665 -0.261123
H 4.069422 2.143811 -0.190820
H 3.841536 1.085662 1.195725
H -2.680167 2.658902 -0.089120
H -3.199072 1.665249 1.276810
H 1.056576 0.045663 2.205651
H 1.452873 -1.654275 1.930608
H 2.742121 -0.452986 2.036782
H 4.183980 -1.590617 0.779297
H 4.555725 -2.108750 -0.866981
H 4.585934 0.232106 -1.687810
H -3.419345 -0.170002 2.083743
H -3.641192 -1.895725 1.770128
H -2.027212 -1.255590 2.116089
H -5.183446 2.223260 -0.118726
H -4.364636 1.669104 -1.585463
H -5.343526 -0.086637 0.764589
H -5.821016 -0.186909 -0.974035
H 6.445547 -0.452241 -0.379354


%chk=000245230-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245230

0 1
O -4.104961 -0.962453 -0.661284
O 5.960660 0.285977 -0.309544
C 0.174636 -0.501738 -0.255895
C 1.675176 -0.420975 0.226203
C -0.716268 0.649986 0.323137
C 2.223440 0.993949 -0.187197
C -2.160088 0.535655 -0.257590
C -2.808086 -0.845042 0.078846
C -0.090212 2.037505 0.022728
C -0.475928 -1.891218 -0.015294
C 1.393279 2.133432 0.439283
C 2.531101 -1.489537 -0.527760
C -1.934583 -1.963654 -0.520512
C 3.740195 1.159044 0.069740
C -3.121465 1.694631 0.108592
C 1.786147 -0.664407 1.757319
C 4.054376 -1.333138 -0.292408
C 4.542257 0.079780 -0.667608
C -3.058336 -1.087668 1.586392
C -4.481132 1.504653 -0.608278
C -5.066928 0.105206 -0.338966
H 0.199387 -0.343615 -1.360818
H -0.774680 0.537225 1.427157
H 2.075549 1.062082 -1.291206
H -2.060738 0.547703 -1.367216
H -0.666003 2.831383 0.534861
H -0.172647 2.235479 -1.068070
H -0.444139 -2.138347 1.063752
H 0.109343 -2.675134 -0.530671
H 1.806536 3.111232 0.119838
H 1.482090 2.105018 1.543951
H 2.320640 -1.409245 -1.616118
H 2.229755 -2.509161 -0.221805
H -1.961322 -1.854864 -1.622521
H -2.380498 -2.947943 -0.281344
H 4.072374 2.157159 -0.274925
H 3.978070 1.102636 1.149740
H -2.687322 2.664076 -0.195340
H -3.268789 1.745112 1.206883
H 1.099275 -0.021144 2.333515
H 1.545738 -1.714616 2.004000
H 2.806133 -0.467248 2.128791
H 4.307557 -1.519441 0.769106
H 4.599357 -2.093504 -0.890105
H 4.411075 0.219905 -1.766470
H -3.634414 -0.276012 2.062719
H -3.626714 -2.027296 1.704887
H -2.111094 -1.188037 2.142906
H -5.207374 2.276499 -0.284441
H -4.332135 1.625992 -1.699409
H -5.397547 0.023085 0.718999
H -5.935351 -0.100928 -0.988116
H 6.503707 -0.420843 -0.743338


