%chk=000278404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278404

0 1
O 1.139318 0.346858 1.277138
O 1.682697 -2.868899 0.943549
O 3.988033 0.575410 1.169787
O 2.590096 -2.338837 -2.403382
O 3.897570 3.492268 1.079721
N -0.986846 -0.637276 1.075134
N -3.191637 -0.215466 1.607515
N -1.107565 -0.106983 -1.384706
N -3.360069 0.544343 -2.095435
N -5.195601 0.670649 -0.609537
C 2.137593 -0.925457 -0.488826
C 1.839941 0.505489 -0.000490
C 1.071943 -1.806867 0.203532
C 0.445214 -0.905528 1.306164
C 3.099009 1.324161 0.335782
C 2.092982 -1.052944 -2.013918
C 2.743552 2.651637 1.032269
C -1.614752 -0.238410 -0.114679
C -2.006188 -0.579541 2.095036
C -2.990180 0.006592 0.233300
C -3.869333 0.411085 -0.815087
C -2.035751 0.281786 -2.305278
H 3.149469 -1.242008 -0.116814
H 1.147636 1.055919 -0.675794
H 0.330766 -2.234564 -0.506431
H 0.595727 -1.305661 2.340030
H 3.718426 1.506834 -0.575861
H 2.675372 -0.259023 -2.511910
H 1.054137 -1.053788 -2.410027
H 2.010848 3.250400 0.459502
H 2.360478 2.483637 2.055863
H 2.026436 -3.552359 0.323799
H -1.783173 -0.827610 3.124325
H 3.500692 0.229732 1.957186
H 3.560153 -2.385606 -2.282842
H 4.641315 3.009101 1.511439
H -1.682089 0.401315 -3.344635
H -5.593939 0.588290 0.314069
H -5.790480 0.957921 -1.371488


%chk=000278404-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278404

0 1
O 1.137787 0.308646 1.236363
O 1.263861 -3.138301 0.465523
O 3.820138 0.884707 1.485022
O 2.885785 -2.744590 -2.021706
O 3.854457 3.641183 0.888645
N -1.038540 -0.717419 1.047308
N -3.251631 -0.565582 1.651404
N -1.182885 0.283986 -1.238033
N -3.485591 0.940614 -1.805417
N -5.306707 0.645436 -0.329104
C 2.282770 -1.000669 -0.392078
C 1.923342 0.455653 -0.043565
C 1.002457 -1.779970 0.002784
C 0.400300 -0.966303 1.179238
C 3.101893 1.378668 0.289721
C 2.668968 -1.284193 -1.848201
C 2.682705 2.842221 0.530831
C -1.701712 -0.133933 -0.043202
C -2.019786 -0.941477 2.030941
C -3.063751 -0.054426 0.351854
C -3.971641 0.512103 -0.590977
C -2.149333 0.804780 -2.055566
H 3.101869 -1.322095 0.283401
H 1.259111 0.902923 -0.809750
H 0.299572 -1.786521 -0.852642
H 0.558875 -1.501278 2.130861
H 3.852745 1.346667 -0.520798
H 3.570245 -0.720436 -2.160449
H 1.838570 -1.039202 -2.532054
H 2.277594 3.293398 -0.391379
H 1.904039 2.880585 1.322453
H 1.679081 -3.608011 -0.307885
H -1.771837 -1.390065 2.990965
H 3.112306 0.633413 2.139997
H 3.802945 -2.969351 -1.722899
H 4.358276 3.110481 1.562586
H -1.812609 1.160120 -3.034132
H -5.682091 0.334680 0.564604
H -5.909775 1.060159 -1.036663


