%chk=000248125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248125

0 1
O 3.834169 -1.178521 -1.947340
O 6.407186 1.239957 1.031998
O -6.592027 -1.663053 0.915284
O -4.889735 -0.928892 2.153384
N 1.429958 -0.599581 -0.088501
N 4.171475 1.048923 1.540406
N 5.119819 0.028236 -0.464113
N 1.711872 0.678259 1.816921
N -0.537711 -0.240290 1.412520
N -1.455263 -0.038995 0.405871
C 2.786439 -0.229463 -0.019978
C 2.929198 0.541120 1.170826
C 3.874216 -0.533758 -0.917014
C 0.814876 -0.027129 1.016906
C 5.317141 0.800632 0.719226
C 0.821666 -1.370781 -1.173888
C 4.313869 1.843567 2.784446
C 6.339713 -0.202527 -1.287160
C -3.702226 0.194877 -0.379220
C -2.712729 0.116118 0.717965
C -5.005851 -0.324766 -0.209541
C -3.361713 0.802267 -1.598875
C -5.934880 -0.237640 -1.260639
C -4.295518 0.888734 -2.633580
C -5.583187 0.368352 -2.466837
C -5.416624 -0.957674 1.060953
H 0.253191 -2.228643 -0.766808
H 0.118861 -0.745773 -1.757887
H 1.606397 -1.754696 -1.862822
H 5.359373 2.189841 2.897163
H 4.043238 1.230315 3.662444
H 3.645678 2.722738 2.754152
H 6.091168 -0.836143 -2.159627
H 7.117806 -0.706917 -0.688301
H 6.747651 0.757705 -1.647053
H -0.736503 0.109533 2.370446
H -3.134631 0.175080 1.741633
H -2.356168 1.206347 -1.736312
H -6.939069 -0.652763 -1.123514
H -4.017632 1.364076 -3.576007
H -6.309955 0.434685 -3.276101
H -6.879437 -2.090157 1.769475


%chk=000248125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248125

0 1
O 3.983999 -0.183266 -2.341121
O 6.573627 0.633765 1.515685
O -7.002152 -0.110751 1.475713
O -4.889538 0.173888 2.355733
N 1.494387 0.030018 -0.442049
N 4.242692 0.566876 1.783521
N 5.255817 0.229718 -0.381173
N 1.779928 0.447019 1.805116
N -0.465200 0.199384 1.068743
N -1.425890 -0.019499 0.115201
C 2.885592 0.144601 -0.199628
C 3.009586 0.397124 1.176817
C 4.010275 0.042009 -1.087352
C 0.890388 0.219763 0.790101
C 5.425425 0.486270 1.006859
C 0.892855 -0.237391 -1.765666
C 4.335353 0.830816 3.231995
C 6.508672 0.152290 -1.167403
C -3.767416 -0.243022 -0.441331
C -2.686396 -0.015818 0.525644
C -5.157545 -0.260763 -0.062940
C -3.445019 -0.457099 -1.815543
C -6.152598 -0.488953 -1.055893
C -4.440042 -0.680005 -2.780222
C -5.806543 -0.697160 -2.401617
C -5.603781 -0.046628 1.340083
H 0.310749 -1.172143 -1.740073
H 0.222138 0.586910 -2.055220
H 1.720956 -0.324754 -2.486115
H 5.401648 0.923237 3.484115
H 3.879842 0.000933 3.797901
H 3.802206 1.763413 3.482179
H 6.226848 -0.049264 -2.211050
H 7.151392 -0.653442 -0.776613
H 7.061978 1.102571 -1.091375
H -0.701890 0.361750 2.059453
H -2.966978 0.151625 1.576945
H -2.389150 -0.442348 -2.099867
H -7.199990 -0.498232 -0.745853
H -4.157929 -0.840681 -3.826592
H -6.587417 -0.870532 -3.148925
H -7.226778 0.040973 2.432718


