%chk=000233704.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233704

0 1
O 0.833851 2.531890 1.293940
O 3.944893 1.684676 -1.527670
O 5.581206 0.478443 -0.577127
O 1.468881 -2.214180 -0.379562
O -5.939683 1.710974 -0.010480
N 3.590105 -1.473886 0.004320
N -4.696377 -0.159498 -0.547887
C 2.905153 0.570903 1.293162
C 3.211344 -0.047013 -0.086342
C 1.467389 0.277550 1.723837
C 0.510032 1.361545 1.250814
C -0.837487 0.940552 0.788584
C 4.398803 0.684250 -0.716684
C -1.898204 1.857733 0.900673
C -1.075065 -0.318315 0.214847
C 2.640181 -2.487366 -0.167206
C -3.410969 0.254951 -0.086850
C -3.181162 1.522392 0.478382
C -2.348406 -0.667797 -0.223140
C 3.179077 -3.883596 -0.072278
C -5.895216 0.597990 -0.487747
C -7.083748 -0.116815 -1.067259
H 3.618332 0.195751 2.052454
H 3.056911 1.676742 1.258398
H 2.305747 0.056061 -0.758401
H 1.400827 0.235108 2.831928
H 1.150355 -0.731466 1.376559
H 4.554954 -1.672983 0.268744
H -1.703555 2.848573 1.324270
H -0.249115 -1.035388 0.096288
H -4.000458 2.242881 0.580580
H -2.509391 -1.645549 -0.670130
H 3.576871 -4.114355 0.925322
H 3.975948 -4.078688 -0.804029
H 2.374772 -4.611819 -0.273796
H -4.735941 -1.094182 -0.961682
H 4.679832 2.215832 -1.944139
H -6.957926 -0.350752 -2.132901
H -7.978467 0.525393 -0.987180
H -7.316496 -1.050039 -0.537512


%chk=000233704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233704

0 1
O 0.828469 2.607610 1.222163
O 4.194498 1.884901 -1.223021
O 5.633872 0.103969 -0.831886
O 1.405819 -2.259147 -0.305795
O -6.049776 1.810166 -0.249835
N 3.582272 -1.488481 -0.013337
N -4.783129 -0.159039 -0.458029
C 2.960045 0.627022 1.254327
C 3.271452 -0.052527 -0.120810
C 1.520321 0.343916 1.747052
C 0.507304 1.378148 1.219696
C -0.857821 0.946602 0.793469
C 4.490195 0.613144 -0.757633
C -1.897593 1.918537 0.772019
C -1.155638 -0.380706 0.373769
C 2.648443 -2.494076 -0.161929
C -3.493840 0.262393 -0.035503
C -3.205124 1.595006 0.376151
C -2.456693 -0.711399 -0.040545
C 3.201376 -3.914781 -0.140498
C -5.966239 0.585042 -0.552088
C -7.172311 -0.202877 -1.060043
H 3.704684 0.264756 1.986902
H 3.077223 1.722211 1.157849
H 2.398215 0.073940 -0.787504
H 1.497609 0.456930 2.850807
H 1.214959 -0.689032 1.525134
H 4.580979 -1.716944 0.027326
H -1.651892 2.941061 1.077697
H -0.370729 -1.141364 0.313173
H -4.001957 2.340106 0.375049
H -2.668826 -1.733359 -0.381225
H 2.719958 -4.478527 0.677008
H 4.295874 -3.960529 -0.010565
H 2.932072 -4.417177 -1.085560
H -4.849117 -1.141982 -0.732415
H 5.012326 2.315635 -1.592907
H -7.534088 0.260762 -1.994223
H -7.987418 -0.122570 -0.320745
H -6.967976 -1.270838 -1.250396


