%chk=000184402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184402

0 1
O 0.350183 1.838654 0.447963
O 0.046461 1.377833 -1.732462
C 1.166204 -1.218088 -0.014501
C -0.206683 -0.444835 -0.073632
C 1.903083 -1.140735 -1.384242
C 2.132962 -0.546272 0.964447
C -1.168815 -1.119571 -1.082852
C -0.889651 -0.384843 1.311910
C 2.942239 -0.010670 -1.285794
C 3.139791 0.285152 0.210807
C 0.941659 -2.684479 0.378367
C -2.501140 -0.368850 -1.198631
C 0.059555 0.977828 -0.588856
C -2.338554 -0.009647 1.261999
C -3.078087 -0.011910 0.144035
C 2.138106 -0.689202 2.288110
C -4.527413 0.361592 0.141005
C 0.599020 3.224106 0.092727
H 1.200115 -0.961670 -2.218611
H 2.401863 -2.099317 -1.607222
H -1.360076 -2.160698 -0.759237
H -0.687300 -1.177018 -2.080870
H -0.341933 0.333654 1.963582
H -0.796678 -1.376782 1.808109
H 2.584008 0.889402 -1.820229
H 3.889967 -0.299198 -1.768014
H 2.982906 1.359189 0.431087
H 4.169063 0.049602 0.535349
H 0.451005 -3.251476 -0.419821
H 1.894940 -3.181440 0.597388
H 0.317207 -2.771266 1.277829
H -3.218520 -0.979123 -1.781536
H -2.355637 0.564001 -1.789516
H -2.761561 0.263568 2.226606
H 1.433920 -1.295427 2.833681
H 2.854722 -0.201864 2.930854
H -4.865775 0.748958 1.110502
H -5.157495 -0.506052 -0.098003
H -4.739748 1.137551 -0.606916
H -0.345950 3.686818 -0.207628
H 1.330861 3.281392 -0.719364
H 0.982476 3.646630 1.026380


%chk=000184402-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184402

0 1
O 0.381727 1.879007 0.324380
O -0.180686 1.288278 -1.841898
C 1.205131 -1.222303 -0.023132
C -0.229472 -0.460043 -0.066655
C 2.015123 -1.020608 -1.352834
C 2.163504 -0.631328 1.040700
C -1.222907 -1.210092 -1.008056
C -0.883313 -0.367717 1.342366
C 2.928865 0.217140 -1.146257
C 3.236705 0.239680 0.376471
C 0.985917 -2.741646 0.221525
C -2.578787 -0.480299 -1.152428
C -0.028208 0.954546 -0.640887
C -2.339917 0.060028 1.289345
C -3.121608 0.029728 0.174493
C 2.149290 -0.915308 2.366927
C -4.561918 0.502907 0.177906
C 0.584475 3.262805 -0.162364
H 1.363182 -0.913821 -2.237023
H 2.642340 -1.919248 -1.510889
H -1.409761 -2.207055 -0.569794
H -0.777415 -1.357430 -2.008081
H -0.309821 0.334150 1.970247
H -0.810829 -1.355378 1.842412
H 2.406598 1.137598 -1.456965
H 3.847503 0.151199 -1.756223
H 3.232678 1.265544 0.788411
H 4.238692 -0.184234 0.582181
H 0.529383 -3.230072 -0.656771
H 1.963562 -3.221023 0.405211
H 0.346584 -2.946873 1.098665
H -3.316057 -1.174374 -1.607001
H -2.479975 0.363676 -1.863756
H -2.770728 0.420813 2.234829
H 1.408351 -1.582323 2.820572
H 2.896059 -0.487058 3.047058
H -4.865492 0.890725 1.166160
H -5.253866 -0.318557 -0.096533
H -4.717469 1.307594 -0.568562
H -0.339145 3.641045 -0.631696
H 1.402065 3.294596 -0.903594
H 0.840941 3.841226 0.736338


