%chk=000266417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266417

0 1
O 5.506630 -2.622658 -1.967976
O 6.923680 -1.279139 -1.039492
N -2.059424 1.509469 1.804745
N -3.912907 -0.250273 -0.982757
N -4.803394 2.022792 -0.677043
N -3.836333 3.507300 0.857062
N -5.750321 0.535777 -2.250268
N 5.787234 -1.620391 -1.328392
C -2.943045 1.204473 0.705431
C -3.019275 -0.023625 0.017873
C -2.130720 -1.172591 0.336328
C -0.791193 2.174743 1.379442
C -3.873463 2.229707 0.312864
C 0.292391 1.260258 0.883142
C -2.190272 -1.778300 1.600393
C -1.251212 -1.663150 -0.640419
C 2.570071 0.850314 -0.002417
C 1.479717 1.717455 0.464384
C -4.787391 0.783443 -1.290388
C -1.347787 -2.853979 1.892915
C -0.412286 -2.739635 -0.339413
C 2.309114 -0.308286 -0.758821
C 3.902267 1.193709 0.305810
C -0.455034 -3.331149 0.927296
C 4.676288 -0.764864 -0.872540
C 3.355443 -1.116411 -1.195026
C 4.954594 0.390495 -0.122626
H -0.427012 2.737874 2.274438
H -1.023878 2.946542 0.606405
H -1.853090 0.662228 2.347564
H 0.059532 0.191111 0.895846
H -2.906083 -1.426360 2.343197
H -1.243420 -1.215426 -1.634932
H 1.710046 2.786671 0.459713
H -1.393134 -3.327127 2.873166
H 0.266752 -3.127864 -1.097675
H 1.280148 -0.572403 -1.009263
H 4.110442 2.090667 0.889552
H 0.199916 -4.170370 1.158679
H 3.163473 -2.019120 -1.785000
H 5.993296 0.645226 0.115318
H -3.402043 3.617400 1.765662
H -4.613075 4.126735 0.663650
H -6.309387 1.297697 -2.600105
H -5.689053 -0.303765 -2.805521


%chk=000266417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266417

0 1
O 5.509846 -2.685475 -2.059888
O 7.036820 -1.323515 -1.045805
N -1.913757 1.664339 1.582825
N -4.026489 -0.312166 -0.882801
N -4.903077 1.958653 -0.623871
N -3.931923 3.435390 0.921138
N -5.800301 0.470610 -2.193438
N 5.820560 -1.655341 -1.339850
C -2.940925 1.225897 0.675456
C -3.064377 -0.054711 0.068525
C -2.164823 -1.200752 0.395252
C -0.817675 2.515082 0.995974
C -3.942875 2.200197 0.310680
C 0.243483 1.661251 0.341498
C -1.812118 -1.528455 1.732012
C -1.666321 -2.011072 -0.659697
C 2.620990 0.798551 0.163441
C 1.561099 1.664597 0.705162
C -4.872785 0.714260 -1.203611
C -0.955542 -2.618591 2.004632
C -0.806117 -3.096366 -0.388370
C 2.346545 -0.355564 -0.632629
C 3.983112 1.106279 0.457058
C -0.439410 -3.399078 0.945120
C 4.725113 -0.811583 -0.824502
C 3.386157 -1.157358 -1.126873
C 5.036582 0.315809 -0.031488
H -0.373952 3.135630 1.797450
H -1.292282 3.198648 0.267883
H -1.523084 0.916450 2.165245
H -0.119726 0.977239 -0.438253
H -2.262665 -0.978687 2.568626
H -1.980423 -1.783332 -1.683425
H 1.884908 2.391015 1.466301
H -0.703723 -2.866507 3.041700
H -0.429264 -3.712818 -1.212398
H 1.310740 -0.643116 -0.840132
H 4.210348 1.984251 1.072898
H 0.227457 -4.242302 1.155763
H 3.189252 -2.046896 -1.730880
H 6.082768 0.546656 0.185186
H -3.346097 3.554826 1.746901
H -4.672514 4.095695 0.695001
H -6.459527 1.200275 -2.447651
H -5.837204 -0.452716 -2.615359


