%chk=000230523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230523

0 1
O -0.586246 -0.230447 1.394386
O -0.294142 -0.523916 -0.890624
O -3.179731 1.730735 0.724568
O -2.898143 1.455669 -1.401082
N -2.900088 1.061413 -0.251029
C 1.617970 -0.208679 0.528632
C 2.675728 -0.927125 -0.345901
C 0.236367 -0.869876 0.399937
C 1.530379 1.283198 0.148274
C -2.599433 -0.441788 -0.016412
C 4.056837 -0.271731 -0.120122
C -1.959754 -0.632195 1.378373
C -1.640197 -0.957819 -1.113704
C 2.759681 -2.427361 -0.045926
C 2.874479 1.922948 0.005333
C 4.006564 1.226209 -0.132492
C -3.950291 -1.149935 -0.097069
H 1.918227 -0.283914 1.604883
H 2.385674 -0.787480 -1.417692
H 0.209388 -1.966762 0.538781
H 0.916443 1.813995 0.905987
H 0.970278 1.392448 -0.809874
H 4.761636 -0.631729 -0.896060
H 4.481845 -0.603502 0.850726
H -2.409739 0.041482 2.141196
H -2.040289 -1.683371 1.706533
H -1.668511 -2.059855 -1.173422
H -1.865740 -0.515504 -2.109520
H 1.854998 -2.956607 -0.362289
H 3.597727 -2.888726 -0.582562
H 2.911588 -2.625413 1.020567
H 2.866255 3.012225 0.001048
H 4.971464 1.716603 -0.246804
H -4.431958 -1.010134 -1.076669
H -3.850157 -2.232295 0.057185
H -4.654911 -0.782662 0.664443


%chk=000230523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230523

0 1
O -0.631516 0.001724 1.406667
O -0.277883 -0.586462 -0.902371
O -3.214272 1.800978 0.477999
O -2.874022 1.243476 -1.700315
N -2.896527 0.969828 -0.446697
C 1.637029 -0.137463 0.545831
C 2.641746 -0.854156 -0.405424
C 0.228607 -0.729063 0.467225
C 1.611441 1.389998 0.270888
C -2.613270 -0.520039 -0.021301
C 4.070706 -0.307523 -0.143561
C -1.997319 -0.530103 1.395546
C -1.624884 -1.149303 -1.028255
C 2.628818 -2.394239 -0.277137
C 3.007054 1.966283 0.148000
C 4.119197 1.203881 -0.019820
C -3.986941 -1.224095 -0.053242
H 1.977695 -0.300742 1.590293
H 2.354033 -0.587806 -1.442122
H 0.195388 -1.811218 0.741777
H 1.058527 1.899582 1.081543
H 1.034979 1.584583 -0.656329
H 4.738563 -0.635579 -0.966217
H 4.482709 -0.774220 0.778945
H -2.575310 0.104943 2.081879
H -2.004849 -1.583385 1.755681
H -1.605037 -2.245517 -0.836062
H -1.938838 -0.955109 -2.063681
H 1.686224 -2.833036 -0.651665
H 3.453047 -2.835708 -0.868266
H 2.767373 -2.710987 0.775678
H 3.100819 3.059835 0.203837
H 5.106127 1.683713 -0.078729
H -4.424227 -1.184604 -1.065942
H -3.872487 -2.283970 0.234640
H -4.688500 -0.746398 0.652304


