%chk=000239843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239843

0 1
S -1.744586 -2.213255 0.872938
O -0.805009 -1.688225 2.179433
O -2.722069 -3.064111 1.523563
O -0.856690 -2.804181 -0.083883
N -0.330590 0.108802 -0.194708
N 0.486822 0.946994 0.265849
N 6.034315 0.021451 -0.010158
N 2.312018 2.902047 1.077873
C -2.491387 -0.743948 0.372716
C -1.742277 0.353781 -0.072031
C -2.400475 1.535805 -0.506678
C -4.548908 0.486852 0.004303
C -3.889368 -0.672356 0.421783
C -3.794755 1.580413 -0.463311
C -1.623432 2.706300 -1.007737
C 3.754941 -0.771940 -0.478128
C 1.866679 0.668864 0.134827
C -6.038981 0.575816 0.045232
C 4.655185 0.241660 -0.003546
C 2.771421 1.671039 0.607819
C 2.396740 -0.538049 -0.396249
C 4.161692 1.442319 0.529688
C 4.270119 -2.060435 -1.033177
H -4.465425 -1.528659 0.793773
H -4.314637 2.480904 -0.793811
H -0.903523 2.409988 -1.787572
H -2.260766 3.488070 -1.438720
H -1.036617 3.168516 -0.198634
H -6.458643 0.704762 -0.963298
H -6.506839 -0.321603 0.473207
H -6.374421 1.429782 0.651272
H 1.683881 -1.303454 -0.738587
H 4.849245 2.201463 0.886543
H 4.886434 -2.598620 -0.299461
H 3.449354 -2.743303 -1.303849
H 4.860804 -1.906554 -1.945038
H 6.412742 -0.719751 -0.575762
H 6.653117 0.802124 0.130341
H 2.930217 3.465530 1.637621
H 1.332381 2.990378 1.313919
H -0.773911 -2.296518 2.931835


%chk=000239843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239843

0 1
S -1.616925 -2.398920 0.224691
O -0.808565 -2.264809 1.906497
O -2.799236 -3.502775 0.426863
O -0.500632 -2.724572 -0.893863
N -0.302987 0.175223 0.060095
N 0.553524 1.180293 0.019395
N 6.036988 -0.035497 -0.119747
N 2.381311 3.191128 0.057174
C -2.485336 -0.715557 0.118016
C -1.682303 0.453825 0.040885
C -2.393892 1.704836 -0.042068
C -4.574757 0.479493 0.045671
C -3.879061 -0.753670 0.135256
C -3.809490 1.670667 -0.037152
C -1.686511 3.042339 -0.119656
C 3.729013 -0.851073 -0.110656
C 1.896854 0.805245 -0.009537
C -6.090879 0.509052 0.019750
C 4.677797 0.246165 -0.084712
C 2.851656 1.893629 0.005780
C 2.371233 -0.543273 -0.070366
C 4.233602 1.590855 -0.028882
C 4.218248 -2.285111 -0.186011
H -4.402118 -1.712303 0.214270
H -4.343699 2.627609 -0.098113
H -1.001020 3.082495 -0.985099
H -2.421567 3.861933 -0.203878
H -1.063132 3.213385 0.776834
H -6.477545 0.207518 -0.973262
H -6.520768 -0.188974 0.759907
H -6.479550 1.519228 0.233944
H 1.616356 -1.336693 -0.098520
H 4.968660 2.405270 -0.012928
H 4.842754 -2.560394 0.688746
H 3.363740 -2.980014 -0.208442
H 4.817568 -2.474382 -1.100156
H 6.368631 -0.994768 -0.157877
H 6.725540 0.712017 -0.106326
H 3.008274 3.989388 0.061473
H 1.370282 3.320751 0.077435
H -1.007260 -3.150859 2.334767


