%chk=000196064.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196064

0 1
O -1.955729 3.694811 0.692702
O -2.000338 -3.208371 -0.648452
O -4.843000 0.244111 -0.167064
O 0.066066 -4.017098 -0.291807
N -0.270189 -0.831072 0.058241
N 0.341133 1.982090 0.138471
N -2.608334 -0.260505 -0.115505
N -3.374740 1.988616 0.268302
C 1.042139 -0.352554 0.632175
C 1.304040 1.108474 0.239770
C -1.289703 0.166443 0.056046
C 2.177487 -1.279651 0.335778
C 3.410911 -0.842417 0.013465
C -0.237221 -1.715071 -1.133712
C -0.983447 1.511061 0.243606
C 2.689187 1.507488 -0.005685
C 3.689276 0.606415 -0.116184
C -2.026598 2.521923 0.429803
C 4.527536 -1.807159 -0.216834
C 5.092423 1.046785 -0.372665
C -3.712858 0.656303 -0.013283
C -0.627129 -3.099121 -0.640825
H 0.870614 -0.366402 1.756349
H 1.955752 -2.343462 0.459414
H 0.779596 -1.760702 -1.599292
H -0.926684 -1.382503 -1.946815
H 2.857210 2.583749 -0.113994
H -2.826917 -1.263388 -0.250566
H 5.332400 -1.669656 0.520778
H 4.972792 -1.679018 -1.214035
H 4.205538 -2.855935 -0.142418
H 5.189650 2.141200 -0.420317
H 5.470923 0.652203 -1.326758
H 5.772552 0.702383 0.420257
H -4.157442 2.654922 0.363573
H -2.328794 -4.087991 -0.314021


%chk=000196064-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196064

0 1
O -1.990767 3.641997 1.031117
O -2.163360 -3.049129 -0.497702
O -4.850144 0.220836 -0.387972
O -0.098394 -4.120238 -0.389494
N -0.220926 -0.725436 -0.158274
N 0.337273 2.008464 0.303104
N -2.554199 -0.216086 -0.301143
N -3.369159 1.898268 0.332698
C 1.035546 -0.348590 0.598983
C 1.333290 1.126643 0.277849
C -1.259556 0.180253 0.012924
C 2.193403 -1.279718 0.345294
C 3.454814 -0.828066 0.045982
C -0.241212 -1.769657 -1.201883
C -0.965907 1.510270 0.404447
C 2.683830 1.529409 -0.039239
C 3.721543 0.622624 -0.146439
C -2.073597 2.449679 0.635975
C 4.603062 -1.811225 -0.093068
C 5.123171 1.084977 -0.487489
C -3.680880 0.623302 -0.142548
C -0.765267 -3.108006 -0.668326
H 0.747570 -0.397225 1.677409
H 2.021311 -2.351402 0.507880
H 0.787163 -1.933146 -1.557360
H -0.866589 -1.446516 -2.053744
H 2.842838 2.598019 -0.218878
H -2.755801 -1.212429 -0.478126
H 5.391727 -1.617255 0.658614
H 5.085528 -1.732656 -1.085478
H 4.257301 -2.850016 0.038245
H 5.162019 2.181575 -0.593626
H 5.484553 0.639383 -1.434778
H 5.850198 0.793829 0.295304
H -4.162254 2.532313 0.470168
H -2.520026 -3.898144 -0.121927


