%chk=000229485.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229485

0 1
O -0.184187 1.841414 1.179733
O -0.942360 -2.587917 0.052956
N -0.240763 -0.460099 0.737446
C 2.056071 -0.919515 -0.126753
C 2.243642 0.424877 -0.917638
C 4.373284 -0.163070 -0.393367
C 3.521598 -1.301206 0.257106
C 3.558558 0.102852 -1.703483
C 2.777481 1.458826 0.078292
C 1.154047 -0.794720 1.109773
C 4.040655 1.112406 0.387966
C -0.778671 0.874818 0.779790
C -1.173166 -1.416527 0.200062
C -2.180200 0.740947 0.250748
C -2.415034 -0.620158 -0.092235
C -3.156865 1.698159 0.084746
C -3.627397 -1.029401 -0.602456
C -4.403749 1.281281 -0.440842
C -4.633071 -0.047870 -0.775631
H 1.630584 -1.686888 -0.810486
H 1.378088 0.730025 -1.507795
H 5.433460 -0.394056 -0.511714
H 3.796058 -2.284004 -0.150542
H 3.681118 -1.348947 1.342971
H 3.934906 0.948719 -2.289398
H 3.486543 -0.760378 -2.371732
H 2.168503 2.266603 0.437981
H 1.530601 -0.003165 1.800777
H 1.145233 -1.757254 1.671846
H 4.736644 1.574192 1.055610
H -2.981180 2.742100 0.347399
H -3.811562 -2.071770 -0.865518
H -5.191142 2.023522 -0.581278
H -5.600726 -0.350295 -1.179132


%chk=000229485-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229485

0 1
O -0.244025 1.912549 1.157599
O -0.949814 -2.601883 0.008670
N -0.260911 -0.419100 0.660612
C 2.080101 -0.871239 -0.152959
C 2.346676 0.475476 -0.947290
C 4.447903 -0.203278 -0.383945
C 3.530055 -1.309664 0.273646
C 3.654685 0.073955 -1.700636
C 2.902496 1.498471 0.052723
C 1.121157 -0.752856 1.050804
C 4.163536 1.093703 0.385845
C -0.833913 0.883916 0.740888
C -1.191785 -1.378602 0.164215
C -2.242321 0.737690 0.245860
C -2.457376 -0.618920 -0.098821
C -3.256321 1.697050 0.110605
C -3.694232 -1.062345 -0.589262
C -4.512034 1.259239 -0.386787
C -4.727716 -0.099250 -0.730951
H 1.658424 -1.613929 -0.856682
H 1.497174 0.809898 -1.562099
H 5.505476 -0.492083 -0.481724
H 3.774406 -2.313044 -0.119202
H 3.656535 -1.335362 1.371334
H 4.079587 0.904062 -2.289265
H 3.537326 -0.822011 -2.338816
H 2.322971 2.318742 0.482761
H 1.469079 0.036803 1.740301
H 1.089326 -1.715277 1.594008
H 4.824884 1.530473 1.139496
H -3.079064 2.742401 0.381982
H -3.849455 -2.113852 -0.850221
H -5.328354 1.979596 -0.506446
H -5.707476 -0.407830 -1.111042


