%chk=000220496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220496

0 1
O 1.503140 1.768093 0.205864
O -2.780175 -0.346966 0.076028
O -1.266819 2.186847 -1.572121
O 1.042988 2.560462 2.265634
O -0.665233 -0.956356 0.599484
N -1.408300 2.451932 0.694267
C 0.766172 2.871443 -0.409609
C -2.796520 1.954068 0.773497
C -0.718118 2.444188 -0.512985
C -2.871074 0.499558 1.257120
C 1.403085 3.014584 -1.775368
C 1.593923 1.721303 1.581131
C 2.417209 0.566668 1.998523
C -1.626884 -1.541232 -1.562187
C -1.572185 -0.948375 -0.203119
C 3.327720 0.732497 3.055441
C 2.272853 -0.675103 1.364721
C -1.375646 -2.909954 -1.734038
C -1.901375 -0.715310 -2.660605
C 4.105903 -0.350401 3.465335
C 3.054591 -1.755127 1.787025
C 3.969963 -1.592215 2.830427
C -1.406885 -3.454162 -3.019636
C -1.924692 -1.269773 -3.943847
C -1.681228 -2.634990 -4.122051
H 0.880999 3.783561 0.221210
H -3.271141 2.023296 -0.241568
H -3.376790 2.616929 1.453453
H -0.920246 2.601934 1.585401
H -3.866965 0.243934 1.661104
H -2.081403 0.229865 1.982926
H 1.431410 2.045380 -2.300382
H 2.435423 3.376899 -1.703467
H 0.828580 3.701167 -2.413103
H 3.418094 1.700753 3.550423
H 1.536941 -0.795964 0.558695
H -1.156923 -3.539807 -0.871754
H -2.082208 0.357714 -2.507682
H 4.816677 -0.231299 4.281461
H 2.943772 -2.723550 1.300877
H 4.579587 -2.435319 3.155626
H -1.216291 -4.516118 -3.164716
H -2.133578 -0.633525 -4.803036
H -1.703450 -3.064628 -5.123299


%chk=000220496-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220496

0 1
O 1.320043 1.724153 -0.180170
O -2.910275 0.179965 0.090175
O -1.460795 3.023899 -1.703819
O 0.944911 2.112329 2.088273
O -1.140212 -0.634401 1.383268
N -1.448264 2.750479 0.620866
C 0.710880 3.061897 -0.520871
C -2.895202 2.558672 0.746810
C -0.836889 2.932336 -0.604466
C -3.277928 1.128262 1.168297
C 1.327460 3.483085 -1.847195
C 1.437680 1.394875 1.171051
C 2.202411 0.140248 1.388257
C -1.459183 -1.452926 -0.894843
C -1.779008 -0.623565 0.300731
C 2.341257 -0.334583 2.718040
C 2.781993 -0.580076 0.311323
C -0.432551 -2.426096 -0.774671
C -2.134698 -1.280609 -2.130951
C 3.062401 -1.518501 2.970534
C 3.502193 -1.764881 0.569797
C 3.645302 -2.235049 1.897387
C -0.093047 -3.229896 -1.881695
C -1.787279 -2.085211 -3.236275
C -0.770250 -3.062015 -3.113689
H 0.972836 3.751315 0.305072
H -3.340569 2.792154 -0.235351
H -3.310569 3.262290 1.495835
H -0.836760 2.650788 1.445979
H -4.372295 1.043280 1.278280
H -2.773623 0.824507 2.103143
H 1.033060 2.785266 -2.646781
H 2.426900 3.513717 -1.764264
H 0.958920 4.484884 -2.127115
H 1.873216 0.231866 3.529211
H 2.656950 -0.209164 -0.709660
H 0.082492 -2.533578 0.185746
H -2.910457 -0.514894 -2.213135
H 3.167775 -1.886081 3.996796
H 3.952301 -2.320418 -0.260130
H 4.206994 -3.155174 2.094904
H 0.695421 -3.984482 -1.786812
H -2.304018 -1.949344 -4.192408
H -0.504622 -3.686423 -3.974374


