%chk=000228316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228316

0 1
O -1.295212 0.158297 -1.279221
O -3.522429 0.071310 -0.882329
C -0.178876 1.440284 0.395115
C -0.204980 -1.145858 0.459760
C 1.967203 0.091646 -0.006034
C -0.989214 0.147235 0.169025
C 1.162229 1.358233 -0.358333
C 1.111679 -1.147823 -0.338504
C 0.002530 1.731217 1.910362
C -1.053447 -2.412514 0.160701
C 3.319433 0.057816 -0.771558
C 0.753496 3.052688 2.125084
C -1.347867 1.788025 2.636931
C -0.276316 -3.690268 0.508046
C -2.377859 -2.395568 0.934258
C 4.169131 1.298272 -0.458329
C 4.123114 -1.204257 -0.425231
C -2.605050 0.113729 -1.672776
C -2.670138 0.130599 -3.162096
H -0.766497 2.282054 -0.051112
H 0.038036 -1.139263 1.552342
H 2.185910 0.096794 1.088457
H -1.957646 0.171042 0.723164
H 1.762699 2.265054 -0.153841
H 0.949215 1.367229 -1.446700
H 0.882229 -1.166653 -1.422082
H 1.680507 -2.072542 -0.124151
H 0.611421 0.905180 2.355806
H -1.282737 -2.421277 -0.933980
H 3.102159 0.047299 -1.867955
H 1.740025 3.035583 1.646244
H 0.909828 3.249082 3.191078
H 0.201283 3.904232 1.713498
H -1.215724 2.027581 3.697692
H -2.006253 2.554090 2.211776
H -1.883530 0.832924 2.585669
H 0.657019 -3.764995 -0.060886
H -0.868754 -4.583579 0.282452
H -0.019118 -3.729904 1.571818
H -2.946504 -3.316251 0.764850
H -2.222783 -2.303528 2.013102
H -3.025981 -1.564013 0.616274
H 4.387567 1.377448 0.611905
H 5.128253 1.262957 -0.985933
H 3.664173 2.221869 -0.761894
H 4.352354 -1.255499 0.644475
H 5.075484 -1.226570 -0.965381
H 3.576665 -2.116656 -0.688999
H -1.671972 0.180223 -3.624541
H -3.251646 0.995828 -3.515760
H -3.172910 -0.773700 -3.538458


%chk=000228316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228316

0 1
O -1.306950 -0.016958 -1.329082
O -3.355655 1.046640 -0.961882
C -0.195456 1.377972 0.387594
C -0.196257 -1.209018 0.498530
C 2.016516 0.080231 -0.005662
C -0.985274 0.068400 0.146501
C 1.152874 1.313706 -0.378906
C 1.184858 -1.216683 -0.212243
C -0.040019 1.709681 1.912527
C -1.016621 -2.513219 0.227253
C 3.354522 0.042746 -0.814396
C 0.566739 3.121973 2.108498
C -1.387536 1.624839 2.676643
C -0.241757 -3.781364 0.666229
C -2.401302 -2.493201 0.924530
C 4.210627 1.315903 -0.589448
C 4.208668 -1.207184 -0.482432
C -2.525209 0.521303 -1.742172
C -2.702677 0.376927 -3.240388
H -0.806279 2.200757 -0.042390
H -0.020217 -1.159182 1.597349
H 2.292329 0.148152 1.071378
H -1.951717 0.110491 0.671030
H 1.714539 2.247892 -0.209030
H 0.935505 1.266769 -1.465363
H 1.022669 -1.366541 -1.300379
H 1.763583 -2.082560 0.151787
H 0.657918 0.978167 2.369521
H -1.184149 -2.572549 -0.868098
H 3.086148 -0.002778 -1.893342
H 1.571391 3.217631 1.660072
H 0.660060 3.355667 3.185216
H -0.085248 3.891959 1.652021
H -1.271025 2.015280 3.704750
H -2.166410 2.226754 2.170610
H -1.764989 0.589640 2.760891
H 0.688271 -3.927225 0.089780
H -0.865997 -4.682536 0.521059
H 0.026342 -3.728678 1.740072
H -2.925205 -3.453762 0.763592
H -2.291057 -2.353909 2.018435
H -3.060286 -1.693323 0.543504
H 4.440345 1.447699 0.486462
H 5.172565 1.236983 -1.129491
H 3.707209 2.231991 -0.944628
H 4.418123 -1.261186 0.604117
H 5.180253 -1.163272 -1.009109
H 3.713305 -2.147270 -0.781100
H -1.836407 -0.119345 -3.700956
H -2.843217 1.375355 -3.689889
H -3.618245 -0.204659 -3.445764


