%chk=000222525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222525

0 1
O -3.357249 0.803934 0.818333
O 3.363896 0.773244 -0.819163
O -1.324733 -2.030293 -0.813810
O 1.305504 -2.042742 0.812719
N -1.115384 0.248710 0.869937
N 1.117003 0.238611 -0.869781
C -0.574262 1.498200 0.413649
C 0.587505 1.492929 -0.413171
C -1.158747 2.717301 0.780334
C 1.183272 2.706677 -0.779478
C -2.485902 -0.039222 0.873662
C 2.484811 -0.061864 -0.874263
C -2.796993 -1.525143 1.003234
C 2.782182 -1.550548 -1.004283
C -0.567866 3.919312 0.381100
C 0.603550 3.913990 -0.379897
C -2.308540 -2.339569 -0.177598
C 2.286447 -2.360776 0.176399
C -3.118945 -3.557108 -0.494706
C 3.085831 -3.585650 0.493230
H -0.443037 -0.536371 0.929268
H 0.437464 -0.540286 -0.929080
H -2.079327 2.718579 1.370832
H 2.103839 2.699592 -1.369966
H -2.359916 -1.934951 1.940629
H -3.897499 -1.629635 1.139675
H 2.341155 -1.956039 -1.941710
H 3.881652 -1.665131 -1.140967
H -1.025327 4.863887 0.672405
H 1.069744 4.854370 -0.670935
H -2.611985 -4.193578 -1.237356
H -4.094455 -3.284723 -0.927279
H -3.320343 -4.176719 0.388683
H 2.572946 -4.217901 1.235416
H 4.063564 -3.322149 0.926295
H 3.282046 -4.206637 -0.390356


%chk=000222525-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222525

0 1
O -3.337795 0.545166 0.984421
O 3.341419 0.514512 -0.986232
O -1.141178 -1.981791 -1.066212
O 1.123438 -1.990092 1.065622
N -1.003404 0.231970 0.891196
N 1.004222 0.223452 -0.892398
C -0.551681 1.512753 0.447340
C 0.564998 1.507958 -0.446738
C -1.131098 2.734598 0.850677
C 1.156051 2.724677 -0.848686
C -2.315455 -0.197820 0.992600
C 2.312031 -0.218649 -0.995375
C -2.417115 -1.739193 1.017480
C 2.399049 -1.761020 -1.019679
C -0.557293 3.949551 0.412899
C 0.593946 3.944543 -0.409393
C -2.142006 -2.333029 -0.377015
C 2.120171 -2.351264 0.375582
C -3.138794 -3.353701 -0.888659
C 3.108707 -3.379744 0.887544
H -0.276275 -0.499997 0.964355
H 0.270017 -0.501347 -0.966150
H -2.008601 2.722191 1.501199
H 2.033308 2.704646 -1.499351
H -1.655452 -2.156552 1.706426
H -3.416834 -2.026084 1.375925
H 1.632499 -2.171227 -1.707477
H 3.395532 -2.057490 -1.379309
H -1.001771 4.899533 0.728179
H 1.047481 4.890607 -0.723545
H -2.809002 -3.776268 -1.849769
H -4.124610 -2.866348 -1.019588
H -3.282451 -4.162561 -0.147915
H 2.776720 -3.797682 1.849922
H 4.098965 -2.900812 1.016051
H 3.244160 -4.191186 0.148076


