%chk=000298236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298236

0 1
O -4.423133 1.803532 -0.177925
O -2.091677 3.802047 0.301660
O -3.046314 0.290428 -2.286514
O -0.817903 2.391231 2.455571
O 0.805464 0.908974 -0.046139
O -1.074807 -1.467771 1.422788
O 2.815411 1.941861 -0.041597
N -2.640595 -1.971669 -0.154278
C -3.028894 1.838410 -0.538256
C -2.356040 2.446063 0.708958
C -2.585289 0.407820 -0.924822
C -1.027193 1.797752 1.159993
C -3.293969 -0.650994 -0.055298
C 0.142266 2.177080 0.243172
C -1.549192 -2.292466 0.653583
C 2.185785 0.912423 -0.111016
C 2.685301 -0.474013 -0.271969
C -1.014786 -3.686690 0.493003
C 3.871907 -0.679121 -0.993649
C 2.011659 -1.552485 0.317747
C 4.379199 -1.972816 -1.129843
C 2.533169 -2.842274 0.184715
C 3.711914 -3.052105 -0.538702
H -2.892606 2.523441 -1.414660
H -3.078481 2.461094 1.565244
H -1.476488 0.292374 -0.910671
H -1.103486 0.683056 1.278173
H -3.305865 -0.311114 1.010370
H -4.359825 -0.734584 -0.367901
H -0.172444 2.592171 -0.730813
H 0.845483 2.883835 0.725458
H -4.969495 1.745584 -0.993642
H -1.770606 4.317947 1.079114
H -3.031942 -2.630024 -0.816211
H -2.591305 -0.445778 -2.737120
H -0.174330 1.859233 2.969891
H -0.378147 -3.771749 -0.399849
H -0.386897 -3.948602 1.361322
H -1.796606 -4.453201 0.424717
H 4.393164 0.172974 -1.436162
H 1.084708 -1.375724 0.881529
H 5.298275 -2.139820 -1.689962
H 2.027178 -3.682827 0.655425
H 4.116331 -4.059299 -0.639233


%chk=000298236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298236

0 1
O -4.189170 2.580770 -0.081706
O -1.582825 3.408898 0.933432
O -4.086095 0.591501 -1.989266
O -0.164285 1.467134 2.213352
O 1.380824 0.538445 0.158073
O -2.026649 -2.332313 0.338314
O 2.336533 1.162693 -1.870764
N -4.229108 -1.757366 -0.097850
C -2.924877 1.888693 -0.367504
C -2.050974 2.021200 0.887331
C -3.242503 0.435532 -0.782442
C -0.819022 1.079862 0.944016
C -4.003969 -0.354566 0.305207
C 0.152216 1.295509 -0.222532
C -3.198201 -2.684614 -0.006657
C 2.424467 0.547218 -0.781283
C 3.603828 -0.240439 -0.322907
C -3.556238 -4.127396 -0.341292
C 4.781091 -0.189858 -1.114606
C 3.578392 -1.028474 0.857391
C 5.925828 -0.913585 -0.724096
C 4.725587 -1.753958 1.241968
C 5.900792 -1.695824 0.455507
H -2.407341 2.379877 -1.217951
H -2.670749 1.801569 1.782127
H -2.317162 -0.112226 -1.044110
H -1.119511 0.014180 0.988690
H -3.422438 -0.353971 1.244846
H -4.975096 0.133379 0.490664
H -0.227766 0.897006 -1.179581
H 0.407991 2.361681 -0.347729
H -4.732492 2.520517 -0.910817
H -0.979719 3.461147 1.722788
H -5.180008 -2.078803 -0.282251
H -4.282226 -0.306047 -2.357624
H 0.739619 1.059366 2.220436
H -2.890129 -4.490959 -1.142216
H -3.371503 -4.758862 0.545076
H -4.604654 -4.259620 -0.660054
H 4.775240 0.419114 -2.024699
H 2.662201 -1.077979 1.452343
H 6.834136 -0.869950 -1.334482
H 4.704254 -2.365313 2.150529
H 6.790610 -2.258962 0.758527


