%chk=000234990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234990

0 1
O 5.170695 -0.376804 0.674973
O 1.304567 3.174885 -0.163885
O -4.064630 -0.032491 0.366239
O -0.879656 3.743803 -0.096937
O -3.439735 -2.203939 0.326128
N 1.749605 -1.753092 0.270310
C 0.650105 -0.868188 0.130965
C 3.090201 -1.280469 -0.170875
C 1.521967 -3.211423 0.057070
C -0.678565 -1.349315 0.217077
C 0.852181 0.528709 0.030410
C 3.872096 -0.824292 1.078468
C -1.754033 -0.457766 0.209151
C -0.239098 1.400779 0.022713
C 1.265834 -3.599248 -1.397392
C -1.553047 0.923960 0.111737
C -0.042353 2.872218 -0.080417
C -3.123466 -1.035657 0.303151
C 1.637746 4.585586 -0.267901
C -5.452763 -0.453558 0.461062
H 3.657524 -2.092262 -0.679616
H 3.031953 -0.458526 -0.917201
H 2.413933 -3.749924 0.452536
H 0.665734 -3.527877 0.699048
H -0.883091 -2.422137 0.299318
H 1.859074 0.947999 -0.036783
H 4.093703 -1.669093 1.758058
H 3.348734 -0.032256 1.640082
H 1.073075 -4.675357 -1.489170
H 2.118070 -3.365566 -2.045468
H 0.392840 -3.079372 -1.813408
H -2.402454 1.616120 0.106346
H 5.115878 0.491408 0.230179
H 2.731928 4.572532 -0.277786
H 1.240492 5.123468 0.599338
H 1.221800 4.990751 -1.195944
H -5.723280 -1.026728 -0.431162
H -5.984444 0.502741 0.513572
H -5.594322 -1.053322 1.365713


%chk=000234990-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234990

0 1
O 5.288104 -0.536422 0.702785
O 1.349300 3.299401 -0.106045
O -4.121898 -0.006536 0.316226
O -0.915873 3.822157 0.022352
O -3.384495 -2.214539 0.303360
N 1.750962 -1.724761 -0.040333
C 0.672770 -0.831994 0.008856
C 3.124179 -1.262002 -0.297605
C 1.552195 -3.184979 0.081928
C -0.674334 -1.296863 0.105445
C 0.874801 0.582860 -0.030281
C 3.885013 -0.864258 0.993262
C -1.758791 -0.391976 0.164545
C -0.218724 1.477490 0.018172
C 1.199684 -3.880051 -1.253855
C -1.548401 1.004782 0.118334
C -0.009518 2.955455 -0.019101
C -3.126902 -0.984434 0.265684
C 1.626410 4.753462 -0.143932
C -5.508734 -0.514380 0.420007
H 3.690525 -2.074040 -0.789321
H 3.117376 -0.412386 -1.009040
H 2.487325 -3.616390 0.485149
H 0.770946 -3.387507 0.837716
H -0.915877 -2.362633 0.128848
H 1.876851 1.011820 -0.086746
H 3.934910 -1.722970 1.682700
H 3.369402 -0.030722 1.512434
H 1.077398 -4.968280 -1.101104
H 2.000038 -3.726316 -2.000348
H 0.259925 -3.484616 -1.676694
H -2.382564 1.707613 0.159726
H 5.330596 0.323673 0.213725
H 2.721296 4.831634 -0.203492
H 1.241794 5.240854 0.767854
H 1.146566 5.211881 -1.025153
H -5.751625 -1.144604 -0.452254
H -6.135939 0.387540 0.445663
H -5.629895 -1.110664 1.340234


