%chk=000237959.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237959

0 1
O -2.881848 -0.541154 -0.062104
O -0.569902 1.246412 -2.455727
O 1.015688 2.173694 1.766403
O -2.563711 -0.273456 2.167183
N 0.248661 1.640321 -0.357122
N -1.256279 2.207802 1.459258
C -2.396573 1.677514 0.691161
C -2.187771 1.911195 -0.804505
C -0.807865 1.550367 -1.307680
C 1.630234 1.246231 -0.782521
C 0.074570 1.993464 1.019555
C -2.604685 0.187778 1.053112
C 1.827261 -0.236419 -0.583415
C 2.339277 -0.719675 0.628825
C 1.487229 -1.130963 -1.608332
C -3.009262 -2.001330 0.075447
C 2.528238 -2.093033 0.805528
C 1.680169 -2.502854 -1.426861
C 2.203226 -2.984747 -0.222077
C -1.638504 -2.613731 0.244657
H -3.328950 2.219149 1.027705
H -2.379932 2.979865 -1.056893
H -2.938054 1.326787 -1.393901
H -1.382027 2.248306 2.479798
H 2.369417 1.838947 -0.190800
H 1.762485 1.531722 -1.854107
H 2.581855 -0.022911 1.433885
H 1.065192 -0.751109 -2.541651
H -3.685413 -2.211082 0.922292
H -3.487912 -2.248156 -0.890202
H 2.929828 -2.467865 1.745711
H 1.425961 -3.196354 -2.226520
H 2.358192 -4.053114 -0.084426
H -1.670109 -3.705802 0.150544
H -0.925197 -2.238669 -0.505898
H -1.208189 -2.381830 1.230981


%chk=000237959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237959

0 1
O -3.306008 -0.538080 0.171674
O -0.541161 1.124313 -2.475941
O 1.078391 2.406455 1.726679
O -1.915208 -0.436748 2.045992
N 0.269443 1.628380 -0.344976
N -1.222402 2.228443 1.424750
C -2.340868 1.614321 0.706587
C -2.163120 1.873911 -0.803597
C -0.767171 1.496569 -1.291320
C 1.667632 1.294521 -0.768480
C 0.093258 2.106789 0.997635
C -2.463508 0.106619 1.063889
C 2.009245 -0.171842 -0.527292
C 2.532525 -0.588602 0.723572
C 1.802953 -1.134725 -1.548001
C -3.494432 -2.017273 0.368845
C 2.841829 -1.948297 0.950918
C 2.114473 -2.494442 -1.321054
C 2.634946 -2.904552 -0.070996
C -2.367346 -2.790288 -0.319087
H -3.282756 2.090812 1.037417
H -2.319453 2.950531 -1.005684
H -2.894799 1.301261 -1.390689
H -1.318215 2.435520 2.420117
H 2.330902 1.954522 -0.187636
H 1.733677 1.541430 -1.840249
H 2.685800 0.154813 1.514741
H 1.388757 -0.811988 -2.510157
H -3.526330 -2.219965 1.453670
H -4.477663 -2.210629 -0.087983
H 3.245461 -2.261017 1.920515
H 1.957185 -3.230797 -2.117580
H 2.880650 -3.958343 0.103950
H -2.563240 -3.875671 -0.238662
H -2.304628 -2.528758 -1.389216
H -1.393516 -2.581892 0.154951


