%chk=000228989.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228989

0 1
O -5.284057 0.002891 1.624774
C 3.248605 -0.089431 -0.089086
C 3.631802 0.928712 1.022184
C 1.733969 -0.296159 -0.130382
C 3.810999 0.405055 -1.434539
C 3.893500 -1.453880 0.241082
C 1.008944 -0.295503 -1.328976
C 1.036433 -0.530126 1.069561
C -1.059259 -0.738791 -0.134525
C 2.961400 2.289693 0.863187
C -2.545739 -0.973577 -0.132269
C -0.373104 -0.511268 -1.333417
C -0.340215 -0.746817 1.071580
C -3.312955 0.295641 0.289078
C -3.242741 1.397649 -0.766120
C -4.776350 -0.070954 0.529269
H 4.731807 1.054706 1.029768
H 3.376726 0.506826 2.014154
H 4.888361 0.590835 -1.365595
H 3.339755 1.344219 -1.744709
H 3.661721 -0.329128 -2.232905
H 3.563205 -1.837325 1.211652
H 4.985278 -1.385739 0.265933
H 3.627577 -2.206390 -0.509642
H 1.511802 -0.129087 -2.280535
H 1.577618 -0.539989 2.015890
H -2.788264 -1.805738 0.562846
H -2.887521 -1.312830 -1.130643
H 3.268499 2.788422 -0.062856
H 3.216748 2.954613 1.695515
H 1.867904 2.198883 0.836745
H -0.912744 -0.502577 -2.278106
H -0.858637 -0.922789 2.012600
H -2.876113 0.679702 1.247485
H -3.669995 1.087370 -1.725641
H -2.197050 1.680260 -0.956529
H -3.766941 2.303248 -0.438174
H -5.342767 -0.404827 -0.353752


%chk=000228989-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228989

0 1
O -5.562557 -0.302446 1.472650
C 3.280552 -0.104751 -0.071785
C 3.626342 1.026702 0.959128
C 1.749190 -0.315659 -0.141267
C 3.890335 0.251882 -1.452069
C 3.947428 -1.427531 0.416884
C 1.013704 -0.232265 -1.349750
C 1.019231 -0.629487 1.039893
C -1.102909 -0.763011 -0.201919
C 3.040113 2.418896 0.641309
C -2.607367 -0.988368 -0.219122
C -0.383483 -0.452743 -1.379935
C -0.372120 -0.846776 1.012583
C -3.408856 0.221440 0.382075
C -3.234085 1.505512 -0.466731
C -4.882177 -0.154377 0.430184
H 4.731590 1.095987 1.024377
H 3.278868 0.711268 1.963013
H 4.977816 0.420072 -1.343687
H 3.450768 1.168995 -1.883154
H 3.751080 -0.569632 -2.179009
H 3.586237 -1.719733 1.419561
H 5.045781 -1.305447 0.474323
H 3.727053 -2.259052 -0.277168
H 1.527208 0.002519 -2.286934
H 1.545524 -0.709383 1.998475
H -2.857421 -1.895013 0.365900
H -2.953282 -1.164236 -1.256780
H 3.445550 2.830836 -0.300551
H 3.283189 3.135564 1.447230
H 1.940019 2.374822 0.547349
H -0.918773 -0.387009 -2.335843
H -0.898833 -1.094725 1.943164
H -3.064736 0.400623 1.417542
H -3.625857 1.360858 -1.492319
H -2.164670 1.766143 -0.546076
H -3.766731 2.360084 -0.012928
H -5.345521 -0.304759 -0.583709


