%chk=000229956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229956

0 1
O 3.419583 -2.679310 -0.503995
O -8.133444 -0.388430 -0.776614
O -7.902113 0.343767 1.245704
N -0.992218 0.616733 0.269455
N -7.456518 -0.026991 0.172302
C 3.210994 0.821190 0.097999
C 4.672001 0.611502 0.018918
C 2.561933 -0.436877 -0.093955
C 4.917600 -0.777424 -0.221344
C 3.606870 -1.508117 -0.306448
C 2.467020 1.967766 0.318546
C 1.190353 -0.551914 -0.072595
C 5.723476 1.500459 0.137259
C 6.202994 -1.264038 -0.340353
C 0.430678 0.629287 0.148740
C 1.063956 1.865220 0.349587
C 7.038360 0.997800 0.014657
C 7.275718 -0.352601 -0.218707
C -3.218076 -0.064822 -0.304312
C -1.746518 -0.098613 -0.502222
C -4.048570 -0.479114 -1.362349
C -3.783755 0.361348 0.909076
C -5.984652 -0.039595 0.007559
C -5.433666 -0.466143 -1.210968
C -5.169086 0.375425 1.070326
H 2.947211 2.932863 0.471136
H 0.706508 -1.519925 -0.204058
H 5.555771 2.558930 0.320225
H 6.388856 -2.323323 -0.523038
H 0.459034 2.756581 0.533181
H 7.877327 1.689116 0.106462
H 8.297382 -0.720174 -0.309623
H -1.406041 -0.745095 -1.329859
H -3.614937 -0.808139 -2.307698
H -3.131539 0.689579 1.725459
H -6.093940 -0.783345 -2.026095
H -5.623548 0.705822 2.011442


%chk=000229956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229956

0 1
O 3.341999 -2.579918 -0.958544
O -8.165641 -0.877905 -0.697908
O -8.035936 0.610561 1.027026
N -1.001263 0.732554 0.322486
N -7.497252 -0.120670 0.108145
C 3.249258 0.840562 0.189911
C 4.709555 0.600426 0.063954
C 2.559745 -0.351094 -0.193433
C 4.911430 -0.738832 -0.392741
C 3.573816 -1.401589 -0.572838
C 2.513966 1.962276 0.617086
C 1.166607 -0.444433 -0.178002
C 5.814766 1.434016 0.310479
C 6.196380 -1.258348 -0.608618
C 0.412271 0.699739 0.237921
C 1.102709 1.876200 0.651872
C 7.118232 0.911334 0.094419
C 7.311456 -0.416905 -0.358792
C -3.226508 -0.025708 -0.290408
C -1.763053 -0.012429 -0.443259
C -4.012172 -0.841363 -1.152827
C -3.872195 0.760921 0.707769
C -6.021521 -0.087829 -0.030476
C -5.412471 -0.878929 -1.029561
C -5.268488 0.734900 0.842173
H 3.011852 2.885484 0.931306
H 0.680016 -1.388384 -0.448057
H 5.686794 2.464009 0.660416
H 6.324152 -2.287806 -0.958968
H 0.496714 2.720954 0.994039
H 7.990721 1.547041 0.281984
H 8.327921 -0.792923 -0.515340
H -1.355325 -0.648957 -1.255848
H -3.518828 -1.448069 -1.921243
H -3.249623 1.379299 1.360852
H -6.036482 -1.497591 -1.679365
H -5.788596 1.328804 1.598193


