%chk=000224622.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224622

0 1
O 1.195222 -0.116861 -1.956127
O -0.873780 0.482723 1.486836
N 1.251353 -2.675034 -0.161474
C 0.731130 -1.297209 0.095011
C -0.786842 -1.252892 -0.152362
C 1.428865 -0.220451 -0.771286
C -1.474859 -0.186595 0.668085
C 2.443368 0.636181 -0.087251
C 2.665414 -2.800085 0.304391
C 1.128125 -3.098065 -1.587164
C -2.933485 0.029654 0.422340
C 2.162832 1.241488 1.144603
C 3.680584 0.852558 -0.712852
C -3.752587 -0.945259 -0.165056
C -3.488222 1.259772 0.812812
C 3.126525 2.047878 1.756754
C 4.644235 1.650482 -0.091945
C 4.367420 2.247403 1.143294
C -5.110923 -0.687865 -0.366590
C -4.845442 1.516783 0.605008
C -5.656993 0.543068 0.014582
H 0.913512 -1.081907 1.187225
H -1.221813 -2.248560 0.095681
H -0.993238 -1.095450 -1.235565
H 3.395450 -2.198952 -0.257505
H 2.964683 -3.859128 0.236884
H 2.729259 -2.516769 1.367802
H 0.061062 -3.191044 -1.843287
H 1.579859 -4.094076 -1.712737
H 1.587499 -2.410911 -2.317841
H 1.184330 1.096666 1.620756
H 3.879815 0.403626 -1.686829
H -3.341294 -1.909767 -0.462255
H -2.846244 2.009831 1.284020
H 2.906790 2.522230 2.712128
H 5.606753 1.814575 -0.573024
H 5.118236 2.872688 1.624840
H -5.745747 -1.446754 -0.821432
H -5.269869 2.473753 0.905357
H -6.716284 0.741674 -0.147625


%chk=000224622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224622

0 1
O 1.208721 -0.153504 -1.959181
O -0.958016 0.697168 1.339865
N 1.263639 -2.574786 -0.049514
C 0.661466 -1.222720 0.159495
C -0.839924 -1.215603 -0.167762
C 1.429947 -0.190124 -0.706077
C -1.576040 -0.083469 0.552087
C 2.536005 0.621975 -0.102429
C 2.557338 -2.792053 0.633318
C 1.237912 -3.114919 -1.424033
C -3.051103 0.079663 0.323090
C 2.526560 1.009660 1.265143
C 3.598356 1.056091 -0.942532
C -3.785345 -0.769301 -0.548630
C -3.731651 1.121693 1.010812
C 3.571290 1.806053 1.782006
C 4.647086 1.838226 -0.420157
C 4.637523 2.212736 0.946039
C -5.172054 -0.578922 -0.727337
C -5.115564 1.311047 0.832277
C -5.840035 0.460245 -0.038141
H 0.785110 -0.991000 1.228770
H -1.276884 -2.187787 0.137283
H -0.987250 -1.112920 -1.261132
H 3.426440 -2.297752 0.139574
H 2.763290 -3.877868 0.670976
H 2.495845 -2.417479 1.670059
H 0.223690 -3.032718 -1.847473
H 1.511565 -4.185589 -1.383364
H 1.933358 -2.598879 -2.125911
H 1.680040 0.740302 1.904522
H 3.573275 0.771572 -1.999953
H -3.280369 -1.576033 -1.089814
H -3.147965 1.765934 1.676775
H 3.550137 2.117168 2.832253
H 5.467999 2.160604 -1.070329
H 5.450608 2.824929 1.352707
H -5.731594 -1.235919 -1.401995
H -5.631901 2.116521 1.365775
H -6.916808 0.607159 -0.178861


