%chk=000235080.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235080

0 1
O 2.125060 3.562301 -0.004382
O 2.276316 -3.473075 -0.052550
N -2.488410 2.332241 0.618057
N -2.385526 -2.450757 0.585101
N -2.284371 -0.055670 0.558479
N -3.941494 -1.310917 -0.753908
N -3.994335 1.145125 -0.736978
N -5.619763 -0.110406 -1.909129
C -0.052839 2.784587 0.302870
C 0.067161 -2.793618 0.264418
C -1.182802 2.490670 1.298892
C -1.074089 -2.562251 1.264057
C 1.276530 3.001364 1.025166
C 1.404929 -2.962362 0.984024
C 3.495057 3.771805 0.421039
C 3.654402 -3.628185 0.370037
C 4.166146 4.351820 -0.825790
C 4.349134 -4.163229 -0.883930
C -2.908508 1.104418 0.128687
C -2.858155 -1.235474 0.112572
C 5.638898 4.649633 -0.574090
C 5.833656 -4.399642 -0.636250
C -4.487316 -0.091507 -1.118905
H 0.048340 1.952761 -0.425584
H -0.278653 3.679295 -0.313940
H 0.131992 -1.948506 -0.452790
H -0.119956 -3.688922 -0.364368
H -1.294238 3.323193 2.030968
H -0.952759 1.568246 1.885977
H -1.149421 -3.408783 1.984585
H -0.883734 -1.638951 1.863833
H 1.197795 3.725890 1.854327
H 1.714414 2.057275 1.391500
H 1.801992 -2.005129 1.362554
H 1.357764 -3.700232 1.803762
H -2.867396 3.163476 0.158784
H -2.728417 -3.291073 0.114128
H 3.506818 4.473380 1.271718
H 3.932569 2.806043 0.724410
H 4.049839 -2.648146 0.685163
H 3.697179 -4.338958 1.212041
H 4.046809 3.642160 -1.669882
H 3.627290 5.268966 -1.139485
H 3.850491 -5.099095 -1.208634
H 4.198339 -3.449228 -1.719285
H 5.775282 5.380065 0.231825
H 6.196634 3.746178 -0.301482
H 6.112914 5.064851 -1.472026
H 6.351737 -3.476117 -0.352861
H 6.002358 -5.133136 0.160716
H 6.324591 -4.782927 -1.539280
H -5.952870 0.750159 -2.315308
H -5.915685 -0.978805 -2.327252


%chk=000235080-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235080

0 1
O 2.245019 2.304219 -0.077840
O 2.403968 -2.472011 -0.360659
N -2.679103 2.368129 0.340297
N -2.443245 -2.323635 0.570818
N -2.493991 0.028231 0.479101
N -4.305432 -1.335049 -0.437243
N -4.423536 1.106392 -0.568095
N -6.125514 -0.249701 -1.431586
C -0.168797 2.408087 0.092643
C 0.023277 -2.440253 0.075962
C -1.395750 2.569778 1.023917
C -1.092924 -2.335140 1.145979
C 1.145736 2.487131 0.875180
C 1.409207 -2.177705 0.674688
C 3.563712 2.320534 0.565523
C 3.762602 -2.080867 0.030531
C 4.620230 2.128171 -0.527564
C 4.704666 -2.439785 -1.123419
C -3.208766 1.127846 0.077422
C -3.094596 -1.172808 0.195003
C 6.055278 2.121109 0.042629
C 6.171522 -2.065422 -0.818406
C -4.913178 -0.156324 -0.791543
H -0.230133 1.425025 -0.406113
H -0.174487 3.185562 -0.693747
H -0.169451 -1.700395 -0.721145
H 0.020140 -3.442414 -0.393203
H -1.406844 3.579458 1.477481
H -1.327209 1.829119 1.841977
H -1.020861 -3.176557 1.861831
H -0.974865 -1.393102 1.709202
H 1.249516 3.471080 1.390232
H 1.181368 1.690656 1.655746
H 1.494179 -1.113522 0.996300
H 1.590972 -2.821154 1.567742
H -3.218808 3.160407 -0.008010
H -2.898358 -3.194324 0.294179
H 3.719899 3.288053 1.096760
H 3.628603 1.503857 1.323081
H 3.793765 -0.985502 0.237160
H 4.062946 -2.613509 0.962976
H 4.410049 1.179210 -1.056993
H 4.506714 2.937568 -1.272833
H 4.619056 -3.524473 -1.323203
H 4.356136 -1.919056 -2.034972
H 6.288761 3.072935 0.556078
H 6.195587 1.301691 0.773422
H 6.798671 1.983780 -0.762950
H 6.281453 -0.978422 -0.642533
H 6.543325 -2.592723 0.080702
H 6.830465 -2.336458 -1.662616
H -6.602808 0.602246 -1.712072
H -6.516468 -1.169160 -1.616217


