%chk=000242096.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242096

0 1
O 3.671954 -0.220004 1.019465
N 1.746634 -0.160517 -0.363663
N 1.511061 1.161390 -0.680208
N -2.910960 0.563424 -0.172569
N 0.326285 -2.125627 0.266757
N -2.063139 -1.598052 0.317800
C 3.120510 -0.728864 -0.189615
C 4.066458 -0.311738 -1.330870
C 4.928875 0.821570 -0.746110
C 4.507681 0.939709 0.726221
C 0.538835 -0.810687 -0.077767
C -0.502952 0.167396 -0.257066
C 0.181255 1.375977 -0.631470
C -1.838420 -0.280740 -0.036800
C -4.305344 0.097292 0.058017
C -5.289954 1.261180 -0.111282
C -0.983089 -2.434361 0.446543
C -6.721294 0.788209 0.123499
H 3.007645 -1.828419 -0.015901
H 3.517493 0.022718 -2.230329
H 4.685680 -1.170370 -1.643901
H 6.003757 0.596964 -0.845559
H 4.749848 1.769980 -1.284244
H 5.333233 0.855265 1.447881
H 3.893557 1.833197 0.927875
H -0.260948 2.333254 -0.851681
H -2.759641 1.531837 -0.425778
H -4.535204 -0.731940 -0.652549
H -4.379288 -0.347023 1.079543
H -5.046713 2.078803 0.597197
H -5.203277 1.696636 -1.127224
H -1.217153 -3.475335 0.729040
H -7.012765 0.002574 -0.584528
H -6.856528 0.384042 1.134470
H -7.433893 1.613561 0.005308


%chk=000242096-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242096

0 1
O 3.787918 -0.718061 0.769342
N 1.680411 -0.067921 -0.256933
N 1.609698 1.329181 -0.153469
N -2.855702 0.942443 0.571587
N 0.136876 -1.986887 -0.123619
N -2.186751 -1.307593 0.297896
C 2.966205 -0.771548 -0.437657
C 3.841110 -0.159960 -1.551538
C 4.657452 0.937796 -0.813550
C 4.761532 0.408399 0.641591
C 0.436070 -0.651479 -0.078634
C -0.489827 0.416812 0.141995
C 0.301309 1.612696 0.086093
C -1.859411 0.025226 0.337065
C -4.277464 0.588262 0.726743
C -5.082763 0.691525 -0.591864
C -1.188581 -2.220565 0.077718
C -6.573520 0.357062 -0.373061
H 2.690707 -1.827437 -0.591613
H 3.240751 0.240485 -2.383768
H 4.504698 -0.952231 -1.940488
H 5.648840 1.091946 -1.271403
H 4.097823 1.885617 -0.834800
H 5.754150 -0.013875 0.879004
H 4.500414 1.181064 1.386128
H 0.007771 2.655157 0.204206
H -2.603048 1.930435 0.543420
H -4.311459 -0.449323 1.097907
H -4.722113 1.252293 1.493297
H -4.983886 1.713544 -1.010226
H -4.639604 -0.003575 -1.329462
H -1.503667 -3.268455 0.058399
H -6.697062 -0.669898 0.017977
H -7.038759 1.052759 0.351035
H -7.139920 0.427406 -1.318816


