%chk=000230941.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230941

0 1
O -2.019678 -1.993421 0.033594
O -3.758646 0.769348 0.921446
O -3.947305 0.652906 -1.341846
N 0.111046 -1.156210 0.001087
N 2.313203 -0.213810 -0.032906
N -1.011916 1.445252 -0.359012
N 4.438781 0.836895 -0.112067
N 2.562232 2.237945 -0.357198
C 0.952355 -0.048921 -0.101721
C 0.671101 -2.524443 0.256648
C 0.354355 1.249351 -0.294645
C -1.329461 -1.005405 -0.058682
C -1.785959 0.398311 -0.253062
C 0.926278 -2.739893 1.742806
C 3.078454 0.930905 -0.165923
C 1.240526 2.368849 -0.416710
C -3.270798 0.613008 -0.347268
C 5.130031 -0.468528 0.079700
C 6.635810 -0.257667 0.123464
C -5.208809 0.927478 1.079648
C -5.892831 -0.408568 0.889706
H -0.067495 -3.269247 -0.128612
H 1.611043 -2.641457 -0.330183
H 1.659289 -2.023157 2.136572
H 0.007131 -2.633251 2.334390
H 1.317468 -3.747594 1.928095
H 0.826417 3.379915 -0.566135
H 5.001450 1.682375 -0.210193
H 4.760624 -0.942117 1.021601
H 4.842557 -1.158534 -0.750397
H 7.153767 -1.216855 0.266283
H 7.025739 0.176546 -0.806646
H 6.943892 0.394554 0.951334
H -5.256147 1.302612 2.118518
H -5.556436 1.694512 0.365677
H -6.948657 -0.367386 1.179427
H -5.848725 -0.734820 -0.161235
H -5.409784 -1.196278 1.484643


%chk=000230941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230941

0 1
O -2.076698 -1.838939 0.200876
O -3.790499 0.582848 1.038677
O -3.864080 1.171487 -1.224531
N 0.126428 -1.024956 0.103098
N 2.340497 -0.170575 -0.027184
N -0.933726 1.581342 -0.362974
N 4.488127 0.764496 -0.196339
N 2.699810 2.233748 -0.481286
C 0.997591 0.045892 -0.079812
C 0.647680 -2.397088 0.357763
C 0.432868 1.346350 -0.325897
C -1.298050 -0.850599 0.067852
C -1.743892 0.548194 -0.161752
C 0.790472 -2.678717 1.866401
C 3.133536 0.929352 -0.232784
C 1.364678 2.407732 -0.520333
C -3.232834 0.799104 -0.211649
C 5.157964 -0.524541 0.041840
C 6.684246 -0.343498 0.038551
C -5.282584 0.692450 1.136748
C -5.939953 -0.627348 0.725173
H -0.074508 -3.095767 -0.095178
H 1.622295 -2.473916 -0.148300
H 1.504092 -1.977716 2.332572
H -0.184992 -2.593177 2.374604
H 1.166215 -3.706792 2.017005
H 0.985166 3.416817 -0.712443
H 5.040736 1.609056 -0.356976
H 4.812973 -0.939832 1.007884
H 4.847183 -1.246619 -0.737748
H 7.179510 -1.313310 0.215567
H 7.041479 0.044426 -0.933165
H 7.008573 0.351397 0.834717
H -5.449424 0.929893 2.199256
H -5.615126 1.531349 0.500074
H -7.030389 -0.568803 0.901298
H -5.771931 -0.833855 -0.344724
H -5.532530 -1.466686 1.313316


