%chk=000214128.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214128

0 1
O -0.198753 1.829732 0.658856
O 0.316539 1.015365 -1.374771
N -4.286471 0.604385 -0.345303
C 1.350876 -0.001075 0.634153
C -2.549703 2.226663 0.330763
C -1.156768 2.793278 0.062026
C -2.883918 1.057208 -0.610407
C 0.881429 -1.433932 0.379361
C 2.776303 0.205959 0.128007
C 0.464887 0.973732 -0.173348
C 1.187946 0.265435 2.137490
C -4.897233 -0.036507 -1.546699
C -4.359752 -0.260647 0.878387
C -0.870146 4.084671 0.808657
C 1.787374 -2.495156 0.531077
C 3.044599 -0.014646 -1.235628
C -0.454343 -1.711580 0.056221
C 3.820843 0.596904 0.974155
C -4.209734 -1.303293 -2.064538
C -5.801947 -0.345697 1.380352
C 1.362630 -3.813651 0.350286
C 4.335087 0.150109 -1.738114
C -0.874949 -3.031716 -0.125668
C 5.115319 0.760858 0.466663
C 0.031038 -4.086027 0.020803
C 5.376440 0.537232 -0.886534
H -3.315325 3.021590 0.216815
H -2.626342 1.899796 1.388170
H -0.931617 2.878917 -1.025604
H -2.128890 0.239137 -0.486948
H -2.800056 1.394421 -1.667180
H 1.801017 -0.418145 2.735135
H 1.454793 1.298900 2.395275
H 0.141975 0.129494 2.447143
H -4.925351 0.732982 -2.350916
H -5.959365 -0.259982 -1.299122
H -3.726712 0.204842 1.668052
H -3.954352 -1.281737 0.707919
H -1.001039 3.963693 1.892079
H 0.166807 4.409919 0.650564
H -1.530736 4.894136 0.477641
H 2.828386 -2.292854 0.785286
H 2.228802 -0.302332 -1.906560
H -1.183619 -0.898617 -0.067082
H 3.645486 0.780272 2.032768
H -3.175825 -1.111765 -2.373604
H -4.185938 -2.091510 -1.304442
H -4.737634 -1.705995 -2.935875
H -6.253557 0.653563 1.445577
H -5.844760 -0.799461 2.375462
H -6.433936 -0.941216 0.712486
H 2.072903 -4.631012 0.465497
H 4.530440 -0.020656 -2.795750
H -1.912597 -3.236985 -0.384033
H 5.919961 1.065741 1.133458
H -0.297312 -5.113338 -0.121945
H 6.383199 0.665397 -1.278912


%chk=000214128-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214128

0 1
O -0.156602 1.591016 0.455947
O 0.160181 0.453141 -1.550804
N -4.465429 0.859144 -0.262946
C 1.291424 -0.369998 0.515912
C -2.478264 2.368691 0.100704
C -1.001194 2.639831 -0.236638
C -3.001911 1.024261 -0.452795
C 1.158144 -1.836399 0.031696
C 2.721987 0.188566 0.262756
C 0.369235 0.562095 -0.319390
C 0.896726 -0.346801 2.019229
C -5.086516 -0.023311 -1.286315
C -4.826859 0.535114 1.141393
C -0.489555 3.988189 0.275594
C 2.254283 -2.726855 0.153343
C 3.251327 0.160209 -1.056122
C -0.088577 -2.357404 -0.398881
C 3.516807 0.734540 1.299372
C -4.679698 -1.523533 -1.251872
C -6.339578 0.611798 1.420544
C 2.112319 -4.098323 -0.154560
C 4.540162 0.663001 -1.327278
C -0.233300 -3.726842 -0.709973
C 4.811854 1.236637 1.029164
C 0.867085 -4.606002 -0.588827
C 5.329433 1.203676 -0.284059
H -3.089785 3.182188 -0.335497
H -2.601850 2.420926 1.199403
H -0.823868 2.525872 -1.322828
H -2.423005 0.187646 0.013141
H -2.790103 0.985675 -1.538126
H 1.581167 -0.994895 2.594429
H 0.917988 0.673850 2.432172
H -0.126066 -0.740615 2.144286
H -4.830208 0.396824 -2.277748
H -6.184816 0.057902 -1.191237
H -4.317443 1.271455 1.789875
H -4.441723 -0.470896 1.451066
H -0.622248 4.069354 1.369032
H 0.581715 4.114512 0.043622
H -1.049456 4.811009 -0.204976
H 3.227014 -2.345967 0.483554
H 2.641193 -0.252106 -1.867339
H -0.950972 -1.691057 -0.512494
H 3.137463 0.772731 2.324609
H -3.589157 -1.648413 -1.385700
H -4.967608 -2.004518 -0.299075
H -5.183437 -2.070586 -2.070477
H -6.739921 1.587156 1.091034
H -6.529864 0.502782 2.504088
H -6.902971 -0.186125 0.904327
H 2.974274 -4.768061 -0.055984
H 4.929391 0.633311 -2.351231
H -1.203845 -4.106308 -1.050017
H 5.412751 1.652253 1.846166
H 0.756181 -5.668691 -0.832173
H 6.332122 1.593148 -0.493497


