%chk=000211784.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211784

0 1
O 2.954749 1.459712 -0.047801
O 2.649241 -0.536838 0.931924
O -2.628698 1.962613 0.210500
O -0.766652 2.226933 -0.858237
N -0.008157 -0.467951 -0.391432
N -2.127030 -0.801497 0.404066
N -1.589416 1.550215 -0.245372
C -0.131199 -1.824382 -0.086290
C 1.179693 0.205053 -0.916268
C -1.256710 0.134392 -0.068162
C -1.451535 -1.997656 0.397649
C 0.946682 -2.810876 -0.247878
C 2.295349 0.272918 0.112040
H 0.913062 1.256713 -1.260998
H 1.559442 -0.320409 -1.829684
H -1.914343 -2.914981 0.728826
H 1.829561 -2.550220 0.373600
H 0.625920 -3.815681 0.073307
H 1.289559 -2.901512 -1.289332
H 3.716080 1.573853 0.590643


%chk=000211784-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211784

0 1
O 3.327334 1.045348 -0.354707
O 2.128670 0.077241 1.393489
O -2.809359 1.876953 0.230692
O -0.781570 2.305822 -0.734283
N -0.045532 -0.441085 -0.398808
N -2.144550 -0.830726 0.417163
N -1.656546 1.500095 -0.185366
C -0.125998 -1.810312 -0.111665
C 1.162011 0.225370 -0.895852
C -1.295998 0.105528 -0.047582
C -1.430309 -2.016348 0.379754
C 1.007405 -2.768208 -0.305917
C 2.212367 0.415684 0.198066
H 0.882464 1.215845 -1.288878
H 1.611333 -0.359417 -1.717286
H -1.875263 -2.953141 0.706811
H 1.851683 -2.536888 0.369674
H 0.665151 -3.790130 -0.078424
H 1.389254 -2.766021 -1.344500
H 4.013050 1.204789 0.348722


