%chk=000260472.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260472

0 1
O 3.358844 -0.924010 -1.010757
O 3.837881 -1.834994 2.053920
O 3.434559 1.542577 1.544991
O 2.934942 2.654159 -0.543095
O -6.240129 0.926506 0.614624
O -5.207816 -1.048666 0.874524
N 1.200892 -1.498911 -0.244801
N -0.797033 -2.118947 -1.222063
N 0.477965 0.712553 0.688184
N -1.913726 1.198883 0.199552
N -3.257883 -0.266192 -1.119633
N -0.588514 2.666308 1.482489
C 3.035013 -0.865859 1.373059
C 2.641815 -1.570593 0.052097
C 3.908586 0.353067 0.958054
C 3.904639 0.358938 -0.594704
C 3.070602 1.444739 -1.296293
C 0.293907 -0.457971 0.005741
C 0.467078 -2.476933 -1.023609
C -0.947956 -0.866136 -0.598238
C -2.061181 0.017869 -0.480455
C -0.667849 1.492774 0.752697
C -4.458960 0.539666 -0.870873
C -5.278299 0.000159 0.286925
H 2.177372 -0.559986 2.011915
H 2.980622 -2.638708 0.008908
H 4.941953 0.255472 1.366417
H 4.940693 0.322517 -0.999740
H 2.020120 1.114618 -1.438568
H 3.502348 1.696981 -2.282490
H 3.905489 -1.607034 3.007231
H 2.507891 1.762031 1.200781
H 0.946479 -3.382242 -1.369940
H 3.801677 2.929942 -0.163282
H -3.407754 -1.233173 -1.428238
H -5.088577 0.559130 -1.795378
H -4.186282 1.613035 -0.663243
H 0.320966 3.030577 1.727962
H -1.343993 3.333675 1.412605
H -6.814081 0.634681 1.374221


%chk=000260472-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260472

0 1
O 3.020529 -0.595264 -1.161292
O 4.188355 -1.867841 1.601883
O 2.877409 1.610287 1.110842
O 4.582162 2.738900 -0.685312
O -7.008996 0.593758 -0.202484
O -5.979565 -1.435730 -0.694433
N 1.063953 -1.451913 -0.093107
N -1.048377 -2.258516 -0.514644
N 0.460975 0.885297 0.522831
N -1.960139 1.286385 0.437103
N -3.490714 -0.394155 -0.186792
N -0.464745 2.969665 1.068251
C 3.160591 -0.875358 1.253631
C 2.529515 -1.432777 -0.058883
C 3.781762 0.497326 0.858836
C 4.106065 0.298046 -0.647354
C 4.077671 1.609041 -1.468135
C 0.184458 -0.390432 0.129050
C 0.259662 -2.547176 -0.491382
C -1.108052 -0.905799 -0.126290
C -2.203270 -0.002410 0.040341
C -0.660516 1.671544 0.662990
C -4.621655 0.509830 -0.025750
C -5.902626 -0.237658 -0.346350
H 2.420997 -0.757460 2.068754
H 2.869762 -2.477252 -0.188572
H 4.699275 0.701957 1.436988
H 5.070469 -0.238155 -0.744111
H 3.033114 1.773549 -1.804081
H 4.729524 1.538633 -2.352874
H 4.669687 -1.569132 2.413874
H 1.888993 1.348092 0.831537
H 0.697830 -3.510071 -0.744638
H 3.964612 2.797643 0.103907
H -3.677497 -1.357334 -0.485573
H -4.537104 1.393303 -0.687985
H -4.679420 0.913376 1.003685
H 0.473401 3.313340 1.260076
H -1.274757 3.573458 1.174425
H -7.841037 0.091507 -0.417464


