%chk=000272854.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272854

0 1
O 0.050909 1.490870 -3.275593
N -0.904723 1.639878 -2.265386
C -1.349126 1.708368 0.119437
C 1.025848 1.318296 -0.652604
C -1.303613 0.420236 0.993668
C -0.890110 2.963588 0.893674
C -0.415728 1.549290 -1.067688
C 1.507857 2.567996 0.117254
C 0.589212 2.903606 1.301338
C 1.072033 0.084476 0.224467
C 0.017903 -0.306804 0.954296
C -2.418601 -0.524972 0.587332
C 2.354659 -0.654060 0.235602
C -3.498371 -0.742793 1.455427
C -2.383062 -1.182875 -0.651399
C 2.776720 -1.350386 -0.907813
C 3.154071 -0.656137 1.389045
C -4.531002 -1.610289 1.086678
C -3.417019 -2.048222 -1.015959
C -4.492868 -2.264377 -0.148123
C 3.989479 -2.043692 -0.893322
C 4.367541 -1.349318 1.395475
C 4.786806 -2.043509 0.256187
H -2.402540 1.868021 -0.224946
H 1.669352 1.171609 -1.557160
H -1.465353 0.736770 2.060242
H -1.522884 3.103208 1.789582
H -1.064629 3.854680 0.257262
H 1.554056 3.424601 -0.582858
H 2.541725 2.402435 0.475654
H 0.724315 2.144178 2.097051
H 0.892598 3.870357 1.745317
H 0.053495 -1.205169 1.571901
H -3.538323 -0.238983 2.418673
H -1.547159 -1.012982 -1.330579
H 2.155029 -1.353282 -1.802230
H 2.826932 -0.116673 2.275680
H -5.366582 -1.775751 1.764237
H -3.384904 -2.554519 -1.979253
H -0.504971 1.594643 -4.115011
H -5.296962 -2.938745 -0.433898
H 4.314041 -2.585944 -1.779988
H 4.987022 -1.349105 2.290654
H 5.731327 -2.583415 0.263779


%chk=000272854-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272854

0 1
O -0.060013 1.433853 -3.351706
N -1.064514 1.608542 -2.268366
C -1.363721 1.710610 0.137640
C 0.965425 1.301456 -0.768905
C -1.298118 0.404010 1.021190
C -0.850364 2.977963 0.894325
C -0.497078 1.523786 -1.088645
C 1.501067 2.592578 -0.048292
C 0.665190 2.924530 1.209772
C 1.099720 0.083070 0.154237
C 0.055287 -0.288182 0.954245
C -2.443429 -0.557636 0.670688
C 2.410986 -0.630811 0.193601
C -3.645793 -0.535922 1.422223
C -2.345904 -1.447920 -0.429268
C 3.197726 -0.804303 -0.979931
C 2.911513 -1.166952 1.415102
C -4.727926 -1.379933 1.085323
C -3.425675 -2.291957 -0.769909
C -4.621322 -2.261956 -0.014797
C 4.425839 -1.499275 -0.936846
C 4.137920 -1.862325 1.459286
C 4.903434 -2.033326 0.281937
H -2.411123 1.877391 -0.169476
H 1.531180 1.156658 -1.702226
H -1.461824 0.725986 2.073135
H -1.433076 3.107249 1.827583
H -1.060192 3.859743 0.256089
H 1.455303 3.433412 -0.768240
H 2.564176 2.443330 0.219477
H 0.859414 2.163141 1.988782
H 0.991860 3.896016 1.627668
H 0.153202 -1.181794 1.586029
H -3.733499 0.143825 2.279961
H -1.419835 -1.477065 -1.015050
H 2.837189 -0.420818 -1.940659
H 2.342565 -1.012488 2.339011
H -5.648355 -1.352766 1.679941
H -3.335016 -2.973356 -1.623629
H -0.629556 1.512994 -4.158830
H -5.457742 -2.919332 -0.278070
H 5.007388 -1.628275 -1.856769
H 4.503444 -2.259634 2.413152
H 5.858648 -2.569012 0.315318


