%chk=000232312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232312

0 1
O -0.132150 -2.367622 -0.828334
O 4.654173 -0.874958 -0.384891
C 0.122926 0.872153 -0.321059
C -0.651179 -0.260134 0.409821
C 1.555304 0.897665 0.232974
C 2.300780 -0.436908 -0.072444
C -2.139745 -0.318027 -0.075368
C 0.073197 -1.632305 0.383214
C -2.775990 1.073023 0.253008
C 3.756297 -0.071690 0.404229
C 1.587698 -1.562924 0.687462
C -0.561040 2.235902 -0.098430
C 2.519520 1.991643 -0.260526
C -2.042879 2.204927 -0.486767
C 3.929802 1.428442 0.017737
C -2.903267 -1.399168 0.737314
C 2.374616 -0.767248 -1.571334
C -4.283374 1.094961 -0.059045
C -2.236827 -0.638179 -1.574281
C -4.415942 -1.373743 0.482352
C -5.018096 0.013053 0.743027
C 4.051180 -0.326225 1.880716
H 0.136760 0.658678 -1.415618
H -0.683585 0.023572 1.495285
H 1.479783 1.005507 1.346082
H -0.413654 -2.316750 1.122850
H -2.657825 1.245506 1.352086
H 1.725714 -1.450315 1.777426
H 2.043300 -2.539726 0.425088
H -0.038571 3.012108 -0.688378
H -0.460156 2.542355 0.960225
H 2.353249 2.946189 0.261989
H 2.379349 2.195255 -1.335575
H -2.511188 3.178150 -0.248992
H -2.149174 2.079488 -1.580731
H 4.568652 1.505064 -0.879062
H 4.435852 1.998569 0.810200
H -2.711428 -1.261900 1.816770
H -2.507345 -2.400433 0.474208
H 1.386508 -0.972834 -2.004205
H 2.827175 0.048070 -2.146263
H 3.011668 -1.650575 -1.733321
H -4.450454 0.940087 -1.142324
H -4.703907 2.089508 0.176246
H -3.259835 -0.507086 -1.942977
H -1.584529 0.003810 -2.172973
H -1.951261 -1.682317 -1.766938
H -4.912040 -2.126011 1.123821
H -4.622822 -1.681107 -0.561293
H -6.092242 0.013209 0.480946
H -4.967220 0.246979 1.823514
H 5.040852 0.042630 2.169612
H 3.321021 0.168580 2.530802
H 4.028143 -1.400576 2.104391
H 0.281310 -1.895676 -1.594258
H 5.571597 -0.788142 -0.073010


%chk=000232312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232312

0 1
O -0.082880 -2.475953 -0.974796
O 4.753688 -1.020651 -0.126672
C 0.136932 0.875703 -0.405585
C -0.651083 -0.295027 0.275104
C 1.585639 0.889956 0.128887
C 2.348897 -0.451432 -0.087020
C -2.172302 -0.332391 -0.148156
C 0.087221 -1.676381 0.262367
C -2.785343 1.056215 0.273374
C 3.773161 -0.080218 0.471603
C 1.586171 -1.567657 0.664530
C -0.556433 2.233980 -0.116915
C 2.571052 1.969852 -0.390174
C -2.068728 2.229992 -0.431131
C 3.986235 1.395154 -0.042612
C -2.911091 -1.450460 0.653531
C 2.514101 -0.791387 -1.599279
C -4.322825 1.113635 0.106340
C -2.354015 -0.592194 -1.671442
C -4.450830 -1.403611 0.506613
C -5.020709 -0.019280 0.894240
C 3.914161 -0.162336 2.006645
H 0.154601 0.729648 -1.505696
H -0.662208 -0.032385 1.361864
H 1.492959 1.031592 1.230340
H -0.408230 -2.323789 1.007015
H -2.585223 1.160547 1.366379
H 1.617195 -1.359798 1.752758
H 2.058434 -2.555731 0.506820
H -0.049714 3.037607 -0.686406
H -0.417240 2.472170 0.960410
H 2.395121 2.954624 0.077022
H 2.454764 2.102717 -1.482897
H -2.518679 3.189041 -0.103094
H -2.232140 2.167861 -1.525606
H 4.640458 1.373854 -0.933025
H 4.492958 2.008494 0.725724
H -2.654300 -1.344123 1.730791
H -2.540905 -2.440798 0.327531
H 1.564637 -0.679440 -2.157683
H 3.246005 -0.127416 -2.088083
H 2.889343 -1.820657 -1.720254
H -4.596801 1.048558 -0.966636
H -4.686733 2.100404 0.458495
H -3.401949 -0.439187 -1.983956
H -1.733807 0.079669 -2.290769
H -2.068156 -1.629919 -1.906570
H -4.905302 -2.192052 1.138530
H -4.734432 -1.639369 -0.538213
H -6.114877 0.008388 0.724040
H -4.860921 0.146184 1.980647
H 4.916671 0.198229 2.311436
H 3.171753 0.467685 2.528765
H 3.804578 -1.202609 2.358594
H 0.425782 -2.050263 -1.708100
H 5.644041 -0.832741 0.265372


