%chk=000271638.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271638

0 1
O 3.224822 2.528090 0.429934
O -1.017830 -2.319912 -0.521545
O -1.298978 2.363340 0.346344
O -5.033727 -0.198519 -0.162536
N -2.990320 -1.259577 -0.333385
N -3.132857 1.087261 0.093626
C 2.807148 -1.017404 0.267962
C 1.315485 -1.119574 -0.131964
C 3.396900 0.277095 -0.328758
C 0.485696 0.101888 0.027659
C 1.152211 1.408940 0.244163
C 3.560233 -2.228570 -0.304277
C 2.940260 -1.005258 1.798444
C 2.661013 1.497344 0.148676
C -0.893470 0.030711 -0.043960
C -1.564483 -1.251300 -0.311032
C -1.716169 1.236320 0.143993
C -3.825212 -0.129599 -0.135377
H 0.857163 -1.983487 0.422602
H 1.222953 -1.475608 -1.190136
H 3.373273 0.244535 -1.437596
H 4.474791 0.367368 -0.073815
H 0.718783 2.197792 -0.440855
H 0.823470 1.856751 1.225380
H 3.143190 -3.174295 0.062963
H 3.523957 -2.263710 -1.398359
H 4.618133 -2.215308 -0.016171
H 3.984478 -0.880286 2.110028
H 2.369370 -0.193829 2.261405
H 2.586830 -1.943128 2.242668
H -3.457869 -2.162242 -0.515396
H -3.705945 1.934873 0.235416


%chk=000271638-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271638

0 1
O 2.822727 2.516744 1.061530
O -0.805524 -2.403554 -0.025172
O -1.340948 2.486002 0.006331
O -4.872606 -0.381847 0.823348
N -2.782980 -1.322104 0.347458
N -3.027181 0.999341 0.414699
C 2.690090 -1.014250 0.184653
C 1.489629 -0.922560 -0.829412
C 3.472828 0.332976 0.166044
C 0.555526 0.221359 -0.490382
C 1.270958 1.553810 -0.553993
C 3.622946 -2.160595 -0.275959
C 2.168619 -1.307293 1.615503
C 2.562315 1.544840 0.316229
C -0.785437 0.074369 -0.117208
C -1.400360 -1.286747 0.053147
C -1.674360 1.267998 0.098342
C -3.654350 -0.244124 0.547832
H 0.971183 -1.888290 -0.859093
H 1.922010 -0.712667 -1.831255
H 3.993439 0.429286 -0.811116
H 4.239921 0.363107 0.959451
H 1.625677 1.707213 -1.596632
H 0.647034 2.408804 -0.269535
H 3.097328 -3.131764 -0.233722
H 3.973909 -2.005243 -1.313785
H 4.511836 -2.227301 0.378443
H 3.015857 -1.452182 2.310704
H 1.550958 -0.479406 2.011029
H 1.550508 -2.222058 1.621338
H -3.188062 -2.257113 0.456140
H -3.620191 1.823951 0.551145


