%chk=000222002.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222002

0 1
O 0.759003 0.489773 -1.080087
O 0.700181 0.540749 1.235792
O 2.956838 -1.950299 -0.859784
O 3.018714 -1.857330 1.297731
O -5.329419 -0.249319 -0.040089
N 2.937316 -1.347326 0.195795
C 2.886519 0.196846 0.140659
C 2.179745 0.656142 -1.153722
C 2.112497 0.723692 1.374081
C 4.351949 0.683867 0.192680
C 0.136775 1.134747 0.047999
C 5.169699 0.314444 -1.038058
C -1.304396 0.729970 0.022224
C -2.310986 1.713113 0.060213
C -1.646151 -0.628148 -0.037248
C -3.648814 1.344955 0.037580
C -2.986305 -1.022669 -0.061624
C -3.973053 -0.029555 -0.023490
C -5.795462 -1.620159 -0.099053
H 2.416512 1.711431 -1.375333
H 2.440727 0.012867 -2.023581
H 2.334856 0.133951 2.291555
H 2.329849 1.791915 1.549601
H 4.841271 0.274720 1.104311
H 4.360828 1.785914 0.324856
H 0.344375 2.221014 0.029744
H 5.091357 -0.753709 -1.290354
H 4.861904 0.875997 -1.927911
H 6.235502 0.524192 -0.877604
H -2.043594 2.769049 0.108285
H -0.849705 -1.377552 -0.066297
H -4.448087 2.081469 0.066073
H -3.238035 -2.076581 -0.108233
H -5.467251 -2.171006 0.787138
H -5.459017 -2.095848 -1.024765
H -6.885146 -1.485917 -0.098383


%chk=000222002-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222002

0 1
O 0.772110 0.411613 -1.135618
O 0.727866 0.398808 1.269262
O 2.857280 -1.969835 -0.952996
O 3.311116 -1.857187 1.271409
O -5.472363 -0.202575 -0.026243
N 3.016268 -1.319852 0.140945
C 2.942208 0.242391 0.107023
C 2.212296 0.703336 -1.172419
C 2.156493 0.718853 1.354506
C 4.412781 0.746379 0.178360
C 0.131155 0.989450 0.055200
C 5.322903 0.299662 -0.986140
C -1.331759 0.657531 0.025352
C -2.310390 1.679896 0.070680
C -1.745529 -0.692538 -0.040813
C -3.680601 1.363697 0.051664
C -3.115219 -1.027243 -0.060172
C -4.085910 0.006871 -0.013029
C -5.950316 -1.586372 -0.092302
H 2.380332 1.798773 -1.276041
H 2.586865 0.182693 -2.063777
H 2.525596 0.219203 2.262075
H 2.300826 1.818906 1.442548
H 4.839950 0.405487 1.140627
H 4.375090 1.852707 0.216246
H 0.324059 2.089939 0.069735
H 5.385416 -0.800104 -1.061280
H 4.972574 0.686799 -1.959426
H 6.346145 0.682317 -0.825525
H -2.002524 2.731415 0.121814
H -0.987779 -1.481186 -0.080032
H -4.449877 2.140562 0.085677
H -3.411606 -2.078920 -0.111453
H -5.615488 -2.170296 0.786850
H -5.611475 -2.085296 -1.020866
H -7.047497 -1.510483 -0.091141


