%chk=000193959.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193959

0 1
O 3.416605 -2.129927 -0.950194
O -9.775809 0.394969 -1.471309
O -9.288432 0.802572 0.672536
C 3.152969 0.450297 0.080876
C 3.961291 2.770143 0.737558
C 5.497329 0.793312 0.986839
C 4.901784 1.651105 -1.309905
C 2.746473 1.817622 0.696720
C 4.283522 -0.157488 0.954294
C 3.684593 0.705260 -1.355316
C 5.078973 2.146699 1.600049
C 4.483724 3.004041 -0.695599
C 6.017324 1.017242 -0.450112
C 1.980946 -0.528143 0.019145
C 2.138171 -1.840061 -0.515497
C 0.709243 -0.192370 0.477245
C -0.373867 -1.093017 0.411647
C 1.079067 -2.750089 -0.587784
C -0.183435 -2.368450 -0.124117
C -1.707161 -0.682092 0.911514
C 3.669297 -3.438861 -1.515475
C -1.760583 -0.250578 2.341459
C -2.777178 -0.709229 0.089027
C -4.129458 -0.331466 0.472017
C -5.158096 -0.324875 -0.399753
C -6.507744 0.054531 -0.005414
C -7.544798 0.068744 -0.862813
C -8.884003 0.457691 -0.417498
H 3.648183 3.741556 1.181452
H 6.302938 0.338875 1.605586
H 5.278723 1.813968 -2.344210
H 2.355579 1.674669 1.719189
H 1.937153 2.277583 0.102695
H 4.588435 -1.141115 0.546825
H 3.912859 -0.347238 1.975153
H 2.885693 1.132180 -1.984198
H 3.972349 -0.254041 -1.827882
H 5.945681 2.827430 1.654577
H 4.730196 2.005747 2.637270
H 3.705107 3.481419 -1.314863
H 5.339399 3.700560 -0.682861
H 6.907475 1.668744 -0.437634
H 6.338806 0.058184 -0.891704
H 0.520249 0.797744 0.897371
H 1.216016 -3.745839 -0.996930
H -1.013768 -3.072544 -0.178005
H 3.068408 -3.588180 -2.416969
H 3.489732 -4.218211 -0.769582
H 4.736954 -3.370268 -1.762382
H -1.918914 0.834610 2.423964
H -0.834225 -0.485358 2.885238
H -2.578351 -0.743515 2.886247
H -2.648971 -1.024686 -0.951464
H -4.280499 -0.046021 1.518297
H -5.016504 -0.605258 -1.446324
H -6.657197 0.337376 1.046843
H -7.458553 -0.200886 -1.917747
H -10.695700 0.654035 -1.200796


%chk=000193959-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193959

0 1
O 3.325009 -2.156373 -1.163702
O -10.284135 -0.906743 -0.758493
O -9.501493 0.616028 0.823258
C 3.298347 0.458127 0.107966
C 4.286135 2.647200 1.026340
C 5.600361 0.500992 1.246852
C 5.306609 1.587415 -1.027032
C 2.988468 1.823133 0.801301
C 4.298568 -0.317427 1.035355
C 4.001774 0.779249 -1.257013
C 5.262287 1.850727 1.931725
C 4.968510 2.934217 -0.337059
C 6.272888 0.770054 -0.126789
C 2.025643 -0.383425 -0.131123
C 2.066031 -1.669675 -0.768396
C 0.749954 0.078102 0.263039
C -0.467359 -0.638880 0.055238
C 0.879828 -2.416671 -0.974710
C -0.365733 -1.911689 -0.569730
C -1.768833 -0.075815 0.493527
C 3.391828 -3.454411 -1.840793
C -1.735707 1.066887 1.494800
C -2.965083 -0.564221 -0.018927
C -4.299911 -0.145230 0.324590
C -5.443373 -0.669028 -0.262173
C -6.774882 -0.249311 0.091200
C -7.931764 -0.747227 -0.471434
C -9.246550 -0.259275 -0.048268
H 4.018654 3.603828 1.518244
H 6.289758 -0.081957 1.890022
H 5.786690 1.780493 -2.007322
H 2.496613 1.647755 1.780261
H 2.287451 2.415211 0.177537
H 4.536775 -1.296554 0.585754
H 3.808289 -0.508874 2.011746
H 3.302990 1.360320 -1.892679
H 4.228959 -0.161279 -1.786695
H 6.187175 2.438355 2.100487
H 4.802321 1.668203 2.924000
H 4.296002 3.533958 -0.983240
H 5.890405 3.529935 -0.180542
H 7.220650 1.327161 0.017351
H 6.526730 -0.190514 -0.618542
H 0.691976 1.056182 0.743576
H 0.923003 -3.405685 -1.439773
H -1.254045 -2.534698 -0.713448
H 2.807702 -3.448922 -2.780958
H 3.035192 -4.271024 -1.184203
H 4.458254 -3.601153 -2.067349
H -1.352939 1.994587 1.025492
H -1.067625 0.832958 2.343570
H -2.731099 1.297947 1.901821
H -2.913313 -1.344367 -0.790790
H -4.436067 0.629951 1.091395
H -5.338718 -1.443262 -1.036798
H -6.885667 0.524486 0.865930
H -7.912497 -1.517930 -1.248838
H -11.153031 -0.542737 -0.438264


