%chk=000183733.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183733

0 1
O -1.805700 2.053271 0.282495
O -3.562942 -2.510895 -0.053195
C 4.286947 -0.036307 0.286778
C 3.752092 1.202189 -0.471742
C 5.827333 0.025032 0.356945
C 3.773775 -1.350450 -0.338158
C 2.272484 1.382896 -0.279867
C 6.411683 -1.007286 1.317792
C 4.266182 -1.615414 -1.758404
C 1.370435 0.968121 -1.273638
C 1.784479 1.972480 0.899734
C -0.004862 1.138195 -1.104205
C 0.414378 2.146343 1.094612
C -0.456233 1.726691 0.081353
C -2.781606 1.081739 0.116508
C -2.518971 -0.293568 0.100709
C -4.075323 1.615402 0.021559
C -3.626132 -1.144698 -0.019695
C -5.148672 0.726469 -0.094210
C -4.944645 -0.650721 -0.120559
C -2.250015 -3.154506 0.057591
C -2.585401 -4.630635 -0.013764
H 3.892468 0.007315 1.334186
H 4.002013 1.114855 -1.548494
H 4.285762 2.111681 -0.126665
H 6.142714 1.038251 0.675790
H 6.256887 -0.118222 -0.653617
H 2.664982 -1.338143 -0.329451
H 4.070134 -2.194982 0.315535
H 6.016556 -0.886386 2.332687
H 6.185082 -2.030916 0.996680
H 7.502248 -0.917394 1.377468
H 3.838369 -2.541544 -2.157590
H 5.357630 -1.716019 -1.792960
H 3.990456 -0.803177 -2.440540
H 1.744674 0.510833 -2.189308
H 2.481317 2.295944 1.672522
H -0.710646 0.833560 -1.874430
H 0.018064 2.603302 1.999195
H -1.508114 -0.667391 0.196611
H -4.223480 2.690419 0.041372
H -6.163365 1.121807 -0.168275
H -5.770372 -1.349544 -0.213426
H -1.624963 -2.813844 -0.785330
H -1.801044 -2.861418 1.022068
H -3.094370 -4.879038 -0.955929
H -3.269822 -4.923135 0.795434
H -1.684666 -5.249859 0.061226


%chk=000183733-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183733

0 1
O -1.858384 1.970791 0.596091
O -3.721180 -2.558634 -0.192641
C 4.415915 0.030103 0.302764
C 3.777964 1.239147 -0.457807
C 5.964636 0.116988 0.218161
C 3.845203 -1.337817 -0.170728
C 2.287310 1.411600 -0.208736
C 6.710223 -0.981364 1.006842
C 4.225765 -1.754240 -1.610415
C 1.319132 1.008358 -1.163994
C 1.821064 1.974973 1.009274
C -0.065322 1.148546 -0.921682
C 0.443759 2.121371 1.273073
C -0.495630 1.700672 0.306443
C -2.882241 1.076134 0.190051
C -2.687812 -0.326018 0.177051
C -4.131634 1.655744 -0.106234
C -3.786300 -1.157674 -0.151201
C -5.212440 0.801917 -0.428970
C -5.052294 -0.596666 -0.459913
C -2.433266 -3.201066 0.138544
C -2.648149 -4.707352 0.019983
H 4.136702 0.138433 1.374336
H 3.971565 1.126736 -1.541988
H 4.313276 2.155909 -0.137862
H 6.276507 1.110095 0.602465
H 6.280337 0.090432 -0.844700
H 2.741583 -1.303825 -0.082124
H 4.184053 -2.125878 0.530092
H 6.394470 -0.992149 2.067504
H 6.519136 -1.986892 0.589760
H 7.802735 -0.813100 0.982709
H 3.759582 -2.722911 -1.868793
H 5.318763 -1.870048 -1.727834
H 3.885085 -1.014661 -2.358442
H 1.651523 0.588662 -2.121475
H 2.548031 2.309457 1.759777
H -0.797625 0.849182 -1.678170
H 0.080994 2.562879 2.206240
H -1.709042 -0.738611 0.433957
H -4.239647 2.743048 -0.077221
H -6.190226 1.236378 -0.663227
H -5.879196 -1.266703 -0.711363
H -1.652552 -2.848022 -0.566795
H -2.133554 -2.916598 1.168321
H -2.956387 -4.977381 -1.004379
H -3.432778 -5.044471 0.718496
H -1.711854 -5.244173 0.258162


