%chk=000273367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273367

0 1
O -1.870667 -0.883924 -0.504802
O -0.643398 2.524906 0.208664
O 2.290391 1.090082 -1.287901
O -2.994650 -0.908570 -2.473714
O -2.885089 2.281205 0.451355
O 1.308272 1.462391 -3.332469
N 0.132547 0.479487 -1.556504
C -1.198182 0.718188 -2.148470
C -1.836249 2.060768 -1.748076
C -2.133456 -0.442849 -1.769452
C -1.910364 2.277182 -0.259402
C -2.643590 -2.032871 -0.009563
C 1.236892 1.067989 -2.188964
C -0.433496 2.600959 1.657437
C -3.137472 -1.681038 1.362831
C 0.120550 1.277889 2.100874
C 3.619779 1.303172 -1.856387
C 4.283736 -0.018008 -2.125826
C -3.002954 -2.615969 2.400983
C -3.755695 -0.447828 1.609206
C -0.638773 0.434494 2.922945
C 1.399964 0.880769 1.682372
C 3.844515 -1.184708 -1.486291
C 5.370002 -0.069893 -3.011834
C -3.495294 -2.318382 3.674370
C -4.240883 -0.153771 2.886669
C -0.112300 -0.792338 3.338680
C 1.921050 -0.345777 2.100414
C -4.114661 -1.088115 3.919213
C 1.167695 -1.181318 2.932659
C 4.489405 -2.399682 -1.732904
C 6.014186 -1.286798 -3.249861
C 5.575683 -2.452204 -2.611962
H -1.095581 0.701490 -3.280667
H -2.861550 2.141088 -2.179458
H -1.251673 2.890469 -2.214363
H 0.155506 0.383159 -0.526258
H -1.911645 -2.861204 -0.020461
H -3.477335 -2.253323 -0.708712
H -1.381990 2.876955 2.155508
H 0.296346 3.428215 1.741401
H 4.119523 1.861434 -1.039994
H 3.534488 1.935377 -2.763147
H -2.518743 -3.573552 2.219425
H -3.845104 0.292870 0.809231
H -1.646381 0.721679 3.228240
H 1.981475 1.520763 1.014190
H 2.992437 -1.137288 -0.805847
H 5.710420 0.830759 -3.519348
H -3.398399 -3.047598 4.476828
H -4.720793 0.806988 3.071668
H -0.710239 -1.447936 3.971434
H 2.914926 -0.650981 1.775891
H -4.499602 -0.859936 4.911364
H 1.576827 -2.135540 3.259700
H 4.143106 -3.306715 -1.240113
H 6.857252 -1.327730 -3.937882
H 6.077635 -3.398881 -2.802618


%chk=000273367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273367

0 1
O -2.186288 -1.099331 -1.321496
O -1.003130 3.564735 0.678072
O 2.286318 -0.752776 -0.752630
O -3.243669 0.783322 -2.220597
O -1.809648 1.378222 0.772759
O 1.996269 1.027873 -2.285868
N 0.189576 -0.011303 -1.221359
C -0.815258 0.822069 -1.880947
C -0.861197 2.270085 -1.326348
C -2.213466 0.192987 -1.827273
C -1.274509 2.318314 0.134176
C -3.504296 -1.792414 -1.126549
C 1.522799 0.162537 -1.494838
C -1.377710 3.775322 2.131356
C -3.531234 -2.421218 0.248064
C -0.205180 3.489919 3.041310
C 3.767184 -0.708400 -1.003648
C 4.176274 -1.660148 -2.107274
C -3.897825 -3.780826 0.398383
C -3.227346 -1.648198 1.398954
C 0.057339 2.166215 3.481713
C 0.647310 4.541205 3.463253
C 4.585742 -2.982472 -1.800605
C 4.155671 -1.238909 -3.462621
C -3.977302 -4.363404 1.684003
C -3.298848 -2.235070 2.680821
C 1.157911 1.900600 4.325134
C 1.747274 4.276813 4.309383
C -3.678202 -3.590851 2.828882
C 2.004704 2.955074 4.741587
C 4.965239 -3.873861 -2.828991
C 4.533826 -2.129377 -4.491556
C 4.940072 -3.447986 -4.177564
H -0.546657 0.916155 -2.953041
H -1.588787 2.861520 -1.912856
H 0.127984 2.740921 -1.453911
H -0.118383 -0.769901 -0.610656
H -3.582445 -2.548809 -1.925835
H -4.294229 -1.031276 -1.266404
H -2.241207 3.123935 2.349482
H -1.672437 4.835671 2.154063
H 4.190439 -1.002951 -0.030392
H 4.036212 0.334629 -1.244047
H -4.121118 -4.386888 -0.488691
H -2.919968 -0.602759 1.285640
H -0.596968 1.352238 3.149272
H 0.451109 5.566129 3.125100
H 4.603154 -3.313730 -0.754845
H 3.829809 -0.219213 -3.697358
H -4.264387 -5.415469 1.790243
H -3.060889 -1.634932 3.566542
H 1.354851 0.875625 4.658257
H 2.399796 5.096003 4.631096
H -3.735709 -4.041231 3.826255
H 2.857468 2.748741 5.398144
H 5.281202 -4.893538 -2.581552
H 4.515103 -1.796278 -5.535330
H 5.236055 -4.137342 -4.976563


