%chk=000244122.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244122

0 1
O 4.392143 -2.031238 -1.134708
O -3.231129 -0.859849 0.959110
O 7.800799 4.514550 0.093986
O 8.139371 3.622521 -1.846509
O -9.101867 3.618206 -0.318698
O -7.475265 4.487685 0.810680
N 0.315334 -3.214184 0.079054
N 3.146802 -2.823742 0.650556
N -3.448920 -2.951896 0.017522
N 4.240860 -0.669909 0.739535
N -5.155540 -1.320771 -0.280245
N 7.633515 3.631871 -0.734801
N -7.998432 3.566137 0.203909
C 1.348953 -3.581852 -0.943798
C 0.775074 -2.040313 0.893236
C 2.669145 -3.935580 -0.229690
C 2.083257 -2.421645 1.614830
C -1.009590 -2.932414 -0.558418
C -2.091160 -3.349943 0.463926
C 3.931482 -1.837248 -0.023557
C 5.111219 0.371116 0.326750
C -3.876695 -1.638776 0.281063
C 5.336428 1.421589 1.252822
C 5.723662 0.400190 -0.943674
C -5.829256 -0.082202 -0.116851
C 6.159398 2.482582 0.902390
C 6.545817 1.464135 -1.287323
C 6.764390 2.507255 -0.367589
C -7.115048 0.028847 -0.704168
C -5.266436 1.009254 0.576494
C -7.818448 1.220594 -0.597355
C -5.975838 2.197941 0.679689
C -7.250751 2.306765 0.093272
H 1.528345 -2.782131 -1.695607
H 0.986466 -4.475131 -1.498261
H -0.013080 -1.807377 1.645026
H 0.919482 -1.118003 0.289720
H 3.456953 -4.181206 -0.979987
H 2.536064 -4.829551 0.421643
H 1.905737 -3.299764 2.284023
H 2.426248 -1.593738 2.267978
H -1.122397 -3.524229 -1.490802
H -1.143879 -1.866698 -0.847911
H -1.884308 -2.884232 1.458791
H -2.080733 -4.451699 0.618858
H -3.873271 -3.519744 -0.707210
H 3.887506 -0.611381 1.701269
H 4.872157 1.406622 2.236766
H 5.557041 -0.417611 -1.658399
H -5.676760 -2.053439 -0.768363
H 6.345560 3.304645 1.604221
H 7.030086 1.501887 -2.271122
H -7.559049 -0.808653 -1.238472
H -4.273635 0.921737 1.038226
H -8.814158 1.327228 -1.045063
H -5.553152 3.057092 1.215636


%chk=000244122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244122

0 1
O 4.847397 -2.076382 -1.220630
O -3.358626 -0.658970 0.828001
O 9.076798 4.007821 0.720264
O 9.748148 2.893088 -1.156477
O -10.039818 2.986145 -0.236502
O -8.283371 4.295619 0.407976
N 0.143151 -2.895679 -0.157370
N 2.921910 -2.182909 0.097134
N -3.622130 -2.911287 0.293728
N 4.546722 -0.498578 0.501525
N -5.470031 -1.472579 0.122297
N 8.945362 3.061665 -0.155206
N -8.798303 3.151491 0.092414
C 1.126372 -3.334237 -1.180120
C 0.533416 -1.576863 0.396253
C 2.521721 -3.457247 -0.542070
C 1.926840 -1.661099 1.057897
C -1.267238 -2.928031 -0.607326
C -2.211174 -3.207386 0.592284
C 4.143643 -1.613593 -0.270831
C 5.660464 0.339951 0.287195
C -4.098121 -1.611744 0.437967
C 5.857369 1.400545 1.222975
C 6.572639 0.186039 -0.798048
C -6.245819 -0.293274 0.135999
C 6.928721 2.292139 1.085221
C 7.645070 1.082041 -0.937093
C 7.818956 2.127071 -0.001366
C -7.622115 -0.415894 -0.220143
C -5.720572 0.985981 0.481666
C -8.461530 0.706030 -0.235731
C -6.562266 2.110116 0.464165
C -7.922100 1.967034 0.107518
H 1.180424 -2.623429 -2.041665
H 0.822458 -4.323174 -1.568771
H -0.207535 -1.255715 1.149401
H 0.558835 -0.793570 -0.402877
H 3.282846 -3.705729 -1.297909
H 2.496346 -4.253488 0.228626
H 1.868850 -2.334109 1.937115
H 2.192698 -0.649368 1.407858
H -1.378564 -3.727943 -1.363341
H -1.577560 -1.971300 -1.088848
H -1.913137 -2.572054 1.442638
H -2.120232 -4.260434 0.908960
H -4.212546 -3.655798 -0.078331
H 4.001839 -0.280298 1.336317
H 5.160368 1.523225 2.061593
H 6.426896 -0.634881 -1.500970
H -5.978695 -2.321951 -0.134031
H 7.091303 3.109155 1.792563
H 8.355497 0.982818 -1.762173
H -8.031940 -1.398430 -0.485624
H -4.669531 1.072799 0.759538
H -9.517662 0.629561 -0.506005
H -6.181947 3.101390 0.724768


