%chk=000245137.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245137

0 1
O 1.971246 -0.837839 -1.341239
O 0.813093 3.061579 -1.636703
C -1.255890 -0.422319 1.187943
C -1.885109 0.600675 0.261092
C -0.997880 -1.681925 0.383422
C -1.187616 1.161751 -0.829709
C -0.084138 -1.693097 -0.689261
C 0.209226 0.805743 -1.126686
C -0.023276 0.070120 1.925654
C 0.653821 -0.473588 -1.050610
C -3.217102 0.975573 0.498776
C -1.693227 -2.859940 0.699033
C -1.843735 2.095360 -1.654931
C 0.131656 -2.875280 -1.419714
C 1.147111 1.899939 -1.513041
C 0.867323 -0.860816 2.484388
C 0.204335 1.440535 2.116552
C -3.857383 1.896586 -0.330425
C -1.479298 -4.027858 -0.034294
C -3.167151 2.457842 -1.409989
C -0.564746 -4.038209 -1.094414
C 2.885570 0.161233 -1.663505
C 2.527112 1.452830 -1.750513
C 1.975145 -0.423286 3.214193
C 1.315093 1.873147 2.846136
C 2.202963 0.944286 3.396841
C 4.210115 -0.467086 -1.872256
H -2.000210 -0.663095 2.002531
H -3.759041 0.546627 1.340215
H -2.407984 -2.863831 1.521373
H -1.297928 2.556571 -2.482632
H 0.848911 -2.872970 -2.242288
H 0.701185 -1.928346 2.348223
H -0.477246 2.177278 1.687412
H -4.889670 2.180292 -0.135529
H -2.026581 -4.935858 0.219379
H -3.659981 3.181864 -2.056776
H -0.399777 -4.951069 -1.664143
H 3.237276 2.240575 -2.000528
H 2.661894 -1.150914 3.642583
H 1.488032 2.940117 2.981871
H 3.066071 1.283839 3.964598
H 4.981786 0.274782 -2.129018
H 4.182282 -1.213936 -2.682746
H 4.548624 -0.998585 -0.966063


%chk=000245137-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245137

0 1
O 2.010912 -0.860603 -1.407344
O 0.885603 3.121747 -1.560972
C -1.274713 -0.419189 1.196243
C -1.903218 0.617502 0.263080
C -1.019526 -1.695860 0.393843
C -1.167877 1.178878 -0.824375
C -0.068509 -1.717651 -0.670354
C 0.242413 0.806524 -1.113297
C -0.041009 0.080315 1.983385
C 0.689341 -0.508003 -1.047722
C -3.249149 1.004065 0.469546
C -1.729622 -2.881511 0.698425
C -1.811699 2.133653 -1.661439
C 0.174265 -2.932995 -1.368057
C 1.201698 1.883740 -1.519545
C 0.878896 -0.848850 2.533002
C 0.140233 1.458418 2.259502
C -3.879896 1.942026 -0.373993
C -1.498901 -4.079469 -0.010826
C -3.153195 2.506199 -1.447175
C -0.535820 -4.105456 -1.046803
C 2.924853 0.117584 -1.814207
C 2.553838 1.433707 -1.864341
C 1.959756 -0.411477 3.330354
C 1.221484 1.898100 3.055186
C 2.136938 0.966046 3.594989
C 4.264103 -0.476344 -2.136232
H -2.040285 -0.668864 1.958416
H -3.803435 0.567417 1.309173
H -2.462449 -2.864604 1.513807
H -1.249042 2.585894 -2.480406
H 0.918796 -2.942644 -2.169347
H 0.753330 -1.919390 2.332592
H -0.556515 2.193190 1.841869
H -4.920455 2.233395 -0.193333
H -2.057143 -4.986106 0.246984
H -3.626345 3.237459 -2.111300
H -0.345209 -5.030465 -1.601210
H 3.276264 2.196495 -2.164581
H 2.661218 -1.144858 3.744862
H 1.350163 2.969078 3.248328
H 2.975975 1.307937 4.211480
H 4.967685 0.311054 -2.448047
H 4.180226 -1.219853 -2.949912
H 4.680926 -0.996936 -1.255048


