%chk=000186892.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186892

0 1
O -2.569603 -2.590436 0.243358
O 4.141967 2.618290 -0.163956
O 4.414490 -2.194343 0.095687
C 0.093501 -0.007425 0.042780
C 1.537650 0.062608 0.018712
C -0.673189 1.171136 -0.008391
C -0.540327 -1.302936 0.111596
C -2.114517 1.088661 0.021064
C 2.168975 1.331441 -0.061409
C 2.312365 -1.134936 0.072820
C -2.741590 -0.181325 0.086801
C -1.922617 -1.359002 0.115077
C 0.004797 2.442271 -0.088495
C 0.289752 -2.495923 0.183318
C 1.363651 2.520598 -0.113803
C 1.637945 -2.416982 0.164440
C 3.590733 1.368706 -0.085942
C 3.711559 -1.020587 0.043533
C -2.944820 2.252474 -0.011565
C 4.375972 0.219979 -0.036036
C -4.166741 -0.268785 0.137722
C -4.314067 2.146658 0.027060
C -4.935159 0.868406 0.106724
C -2.832805 -3.236475 -1.030498
H -0.604563 3.346386 -0.127594
H -0.234300 -3.448711 0.274599
H 1.882958 3.479770 -0.173915
H 2.272576 -3.303740 0.221808
H -2.467579 3.232623 -0.065437
H 5.456121 0.270185 -0.056246
H -4.614637 -1.261354 0.217656
H -4.942442 3.035402 0.002037
H -6.021594 0.811660 0.147125
H 5.133011 2.593903 -0.175900
H 5.393744 -2.047706 0.077600
H -3.322485 -4.166290 -0.720447
H -1.894012 -3.436435 -1.554609
H -3.499719 -2.616866 -1.636073


%chk=000186892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186892

0 1
O -2.584939 -2.631477 0.222823
O 4.214753 2.661117 -0.197681
O 4.469756 -2.243027 0.129278
C 0.107432 0.001358 0.051015
C 1.549208 0.066984 0.022906
C -0.676652 1.203227 -0.012830
C -0.537491 -1.299891 0.137830
C -2.128121 1.113640 0.030558
C 2.196794 1.349460 -0.074148
C 2.326051 -1.146365 0.092026
C -2.760185 -0.187688 0.113067
C -1.945426 -1.366797 0.138098
C 0.013622 2.464487 -0.112968
C 0.277852 -2.494612 0.224688
C 1.398029 2.540296 -0.142503
C 1.655464 -2.422206 0.201936
C 3.623973 1.390066 -0.100990
C 3.741213 -1.042365 0.060939
C -2.979850 2.265804 -0.003276
C 4.390882 0.212065 -0.034586
C -4.190647 -0.283892 0.174393
C -4.372337 2.149369 0.044214
C -4.985150 0.861769 0.138552
C -2.856176 -3.254741 -1.090006
H -0.560997 3.392587 -0.167647
H -0.233215 -3.454778 0.338900
H 1.906458 3.504977 -0.217902
H 2.269950 -3.323332 0.276221
H -2.540449 3.265613 -0.062871
H 5.489197 0.263708 -0.056770
H -4.636270 -1.277711 0.276889
H -4.997460 3.048766 0.017527
H -6.076331 0.780030 0.191960
H 5.201298 2.596428 -0.206643
H 5.443094 -2.071508 0.110346
H -3.340363 -4.218419 -0.868533
H -1.914927 -3.422058 -1.648863
H -3.533040 -2.619986 -1.694750


