%chk=000258915.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258915

0 1
O -3.101943 2.057629 0.328710
O 1.254623 3.558567 0.148803
O 4.907144 -1.905211 -0.462001
O 5.420520 0.767462 -0.239396
N -1.605900 -2.790734 0.277742
N 0.555327 1.405454 0.523582
C 0.090361 -0.998690 0.423633
C -0.583299 0.419543 0.394377
C -0.561956 -2.057231 -0.524108
C -1.326406 0.803352 -0.902152
C -2.180884 -0.370258 -1.410642
C -1.167938 -1.468922 -1.803199
C -0.074163 -1.634845 1.829160
C 1.548039 -0.687104 0.167608
C -1.255911 -2.613175 1.728018
C -2.046480 2.143914 -0.654671
C -3.156242 -0.897732 -0.379483
C -3.003098 -2.364252 -0.039506
C 1.785472 0.712221 0.280918
C -1.112976 3.177802 0.008396
C 0.331518 2.769049 0.205175
C 2.599230 -1.557865 -0.076381
C -4.102805 -0.146146 0.194645
C -4.280507 1.318720 -0.056772
C 3.057396 1.266572 0.157013
C 3.889027 -1.017259 -0.211768
C 4.107695 0.375735 -0.090259
H -1.275382 0.545391 1.266534
H 0.209649 -2.826070 -0.788663
H -0.567440 1.006013 -1.709997
H -2.759340 -0.049063 -2.310914
H -1.656399 -2.264881 -2.397017
H -0.370564 -1.063115 -2.453263
H -0.231707 -0.873005 2.610284
H 0.850512 -2.167655 2.119901
H -0.975209 -3.619880 2.106752
H -2.115121 -2.269147 2.334817
H -2.481922 2.534602 -1.599470
H -3.674679 -2.665074 0.793501
H -3.326620 -2.978228 -0.915778
H -1.544125 3.436200 1.011396
H -1.132535 4.134932 -0.553808
H 2.457879 -2.634515 -0.162106
H -4.794838 -0.567604 0.923492
H -4.545955 1.536560 -1.106886
H -5.040446 1.767733 0.614616
H 3.207898 2.344382 0.245526
H 5.779890 -1.425701 -0.530359
H 5.518109 1.748029 -0.136601


%chk=000258915-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258915

0 1
O -3.242762 2.010084 0.391568
O 1.284729 3.600429 0.165080
O 5.049498 -1.877019 -0.557434
O 5.519805 0.770667 -0.390653
N -1.648280 -2.677691 0.401882
N 0.604027 1.384667 0.479953
C 0.153270 -1.012994 0.460481
C -0.532892 0.402375 0.437640
C -0.557605 -2.071459 -0.455105
C -1.356421 0.786888 -0.817457
C -2.177364 -0.396768 -1.402077
C -1.140499 -1.494341 -1.760875
C -0.013972 -1.688442 1.860046
C 1.607036 -0.689343 0.147862
C -1.451166 -2.246380 1.821109
C -2.078875 2.127109 -0.509445
C -3.248535 -0.987672 -0.470745
C -3.032261 -2.454796 -0.115851
C 1.835022 0.706797 0.239631
C -1.129817 3.115465 0.240693
C 0.355350 2.740112 0.285117
C 2.677860 -1.564000 -0.113631
C -4.252811 -0.241114 0.062853
C -4.385792 1.249511 -0.170194
C 3.118471 1.270575 0.076346
C 3.969220 -1.025449 -0.291008
C 4.174215 0.378646 -0.193142
H -1.174943 0.531923 1.329811
H 0.187993 -2.853893 -0.701241
H -0.618576 1.039700 -1.610528
H -2.672278 -0.033136 -2.328609
H -1.599538 -2.306019 -2.353874
H -0.323983 -1.072144 -2.375772
H 0.153571 -0.980065 2.689616
H 0.722197 -2.507298 1.955622
H -1.588137 -3.095322 2.515981
H -2.180553 -1.454005 2.108590
H -2.422661 2.568863 -1.471233
H -3.746901 -2.784047 0.659102
H -3.193593 -3.107726 -0.995155
H -1.509592 3.168503 1.280083
H -1.190165 4.132983 -0.175130
H 2.547225 -2.648216 -0.181560
H -4.978228 -0.715346 0.737625
H -4.479631 1.486168 -1.254190
H -5.270373 1.652908 0.349413
H 3.256413 2.353342 0.144459
H 5.870593 -1.325150 -0.649412
H 5.629207 1.748618 -0.316843


