%chk=000250631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250631

0 1
O -5.208625 2.131099 2.064855
O -3.410157 2.814586 1.089361
N -4.339764 2.033904 1.210917
C 3.955383 -0.013374 -0.030778
C 3.318059 -1.338611 -0.098092
C 2.918930 0.976980 -0.050395
C 1.894957 -1.150271 -0.158614
C 1.593421 0.304207 -0.136120
C 5.287588 0.354275 0.043780
C 3.871022 -2.607065 -0.105569
C 3.237677 2.323318 0.007329
C 1.058463 -2.251795 -0.221904
C 0.416607 0.953875 -0.186261
C 5.600734 1.727015 0.100920
C 3.005263 -3.716819 -0.172399
C 4.596048 2.691446 0.083531
C 1.625282 -3.541636 -0.228461
C -0.897666 0.330750 -0.278360
C -2.025831 1.049662 -0.404307
C -3.359230 0.442550 -0.497696
C -4.453309 0.903059 0.265317
C -3.573845 -0.635817 -1.379707
C -5.716289 0.287008 0.161956
C -4.826959 -1.233996 -1.490194
C -5.902447 -0.775554 -0.715520
H 6.078268 -0.391628 0.059157
H 4.947772 -2.751556 -0.059958
H 2.465082 3.089083 -0.003415
H -0.026190 -2.130345 -0.262641
H 0.413266 2.051515 -0.155353
H 6.644935 2.031437 0.160280
H 3.427465 -4.720878 -0.178538
H 4.856703 3.748121 0.130048
H 0.968860 -4.409214 -0.276919
H -0.924656 -0.766772 -0.227548
H -2.013514 2.148945 -0.427228
H -2.744257 -0.994609 -1.990938
H -6.543924 0.653301 0.781431
H -4.974268 -2.064965 -2.182840
H -6.879755 -1.250031 -0.800728


%chk=000250631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250631

0 1
O -5.634347 2.985594 1.238852
O -3.518344 3.286233 0.472672
N -4.576826 2.556379 0.627789
C 4.011056 -0.027771 -0.045049
C 3.459581 -1.382787 -0.233405
C 2.912809 0.887169 0.037027
C 2.023076 -1.292541 -0.264933
C 1.637816 0.136631 -0.100902
C 5.339176 0.428231 0.055886
C 4.115646 -2.620294 -0.367922
C 3.150592 2.265580 0.221675
C 1.263833 -2.473696 -0.428765
C 0.397465 0.757880 -0.074080
C 5.571009 1.813487 0.241455
C 3.340467 -3.793048 -0.535339
C 4.486101 2.723282 0.323805
C 1.926575 -3.717655 -0.563847
C -0.911448 0.171483 -0.207477
C -2.059290 0.942863 -0.148147
C -3.429470 0.440240 -0.289098
C -4.611629 1.177802 0.072809
C -3.663489 -0.876933 -0.803955
C -5.911816 0.629757 -0.059131
C -4.948491 -1.420953 -0.945959
C -6.088071 -0.665192 -0.570365
H 6.182977 -0.267696 -0.006205
H 5.209180 -2.681316 -0.343448
H 2.324948 2.982833 0.288317
H 0.171442 -2.459944 -0.449195
H 0.399925 1.848963 0.064006
H 6.597422 2.187957 0.322743
H 3.835110 -4.764821 -0.641610
H 4.684885 3.790737 0.468383
H 1.337499 -4.632572 -0.689999
H -0.984204 -0.911744 -0.341649
H -1.949569 2.015397 0.029297
H -2.803534 -1.471551 -1.125276
H -6.763483 1.240833 0.249239
H -5.068620 -2.428774 -1.357394
H -7.094859 -1.078839 -0.682403


