%chk=000195194.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195194

0 1
O -2.590586 -0.926129 0.983398
O -1.128533 2.248426 -1.333734
O -3.078408 2.082477 0.429625
O -3.823873 -1.133476 -0.976040
O 1.560884 0.645834 1.787415
O 3.970528 1.349487 0.857385
O 5.643913 -2.216802 -0.743657
N 0.707956 0.276399 -0.310736
C -0.702254 0.336157 0.132487
C -1.581335 0.948278 -0.988546
C -1.234512 -1.084882 0.468383
C -3.057118 1.017885 -0.532108
C -3.532799 -0.290284 0.147456
C -0.506515 -1.758284 1.616241
C 1.740561 0.512946 0.586865
C 3.171098 0.542802 0.001859
C 3.723882 -0.882944 -0.083169
C -4.387610 -2.417743 -0.636033
C 5.144721 -0.877232 -0.658915
H -0.780325 0.974010 1.062379
H -1.499239 0.381897 -1.947188
H -1.294093 -1.726331 -0.436476
H -3.719769 1.269401 -1.391738
H -4.407768 -0.164408 0.817521
H 0.869104 0.280557 -1.314443
H -1.209879 -2.342645 2.228484
H 0.278713 -2.432325 1.261062
H -0.033800 -1.027491 2.295157
H -1.304989 2.881001 -0.587406
H -3.980007 2.456578 0.511175
H 3.229928 1.080480 -0.973030
H 3.071406 -1.525964 -0.706689
H 3.726502 -1.352640 0.921039
H -5.412563 -2.286204 -0.278494
H -3.765340 -2.920039 0.112915
H -4.367004 -2.952319 -1.592753
H 5.827319 -0.254889 -0.051035
H 5.171213 -0.539143 -1.711997
H 3.745228 1.177039 1.811810
H 5.794261 -2.587379 0.147631


%chk=000195194-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195194

0 1
O -2.704185 -0.820572 1.098423
O -0.937288 2.107884 -1.479526
O -2.994336 2.123162 0.335933
O -3.638725 -1.231700 -1.098390
O 1.590274 0.903239 1.958285
O 4.108419 1.063943 1.177009
O 5.513430 -2.190101 -1.276822
N 0.746841 0.212960 -0.106451
C -0.675400 0.326308 0.256193
C -1.470026 0.846456 -0.971835
C -1.274283 -1.033346 0.726213
C -2.959560 0.994344 -0.609978
C -3.521613 -0.300570 0.019156
C -0.605188 -1.618088 1.967730
C 1.765867 0.567454 0.741107
C 3.201555 0.548411 0.160058
C 3.650404 -0.869222 -0.270286
C -4.331203 -2.480399 -0.741697
C 5.069034 -0.845551 -0.870022
H -0.761579 1.045400 1.091842
H -1.380288 0.129863 -1.808729
H -1.238683 -1.753591 -0.119854
H -3.542038 1.225551 -1.522654
H -4.510716 -0.129899 0.494950
H 0.969851 0.079278 -1.096056
H -1.131009 -2.537293 2.278726
H 0.448448 -1.868692 1.758411
H -0.627316 -0.893562 2.798220
H -1.231627 2.814494 -0.844011
H -3.919101 2.453563 0.445957
H 3.236965 1.229358 -0.718012
H 2.955680 -1.292596 -1.022403
H 3.625572 -1.528923 0.619891
H -5.376154 -2.274063 -0.432781
H -3.807360 -3.006483 0.077336
H -4.328011 -3.095589 -1.654049
H 5.771191 -0.379811 -0.151871
H 5.083508 -0.259785 -1.805744
H 3.538657 1.234157 1.985662
H 5.668887 -2.733889 -0.463830


