%chk=000249418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249418

0 1
O 6.020793 0.034747 1.078400
O 6.019701 0.020076 -1.083979
N 5.467470 0.155031 -0.003376
C -1.136300 0.616091 -0.003406
C -2.575649 0.998629 -0.005248
C -1.123264 -0.870661 0.006325
C -3.379688 -0.188511 0.002908
C -2.476116 -1.352021 0.010109
C -0.109778 1.475527 -0.009507
C -3.170608 2.248026 -0.013160
C -0.067955 -1.765701 0.011689
C -4.761112 -0.108390 0.003033
C -2.748809 -2.708162 0.019112
C 1.315113 1.109468 -0.007756
C -4.578638 2.322982 -0.012989
C -0.352047 -3.147126 0.020859
C -5.357507 1.168819 -0.005057
C -1.664792 -3.609398 0.024498
C 1.999698 0.960220 1.211914
C 1.998624 0.944357 -1.225982
C 3.356932 0.648472 1.217835
C 3.355852 0.632544 -1.229043
C 4.029012 0.485413 -0.004891
H -0.284317 2.557650 -0.016524
H -2.576564 3.158923 -0.019413
H 0.966359 -1.425898 0.008986
H -5.378123 -1.003713 0.009188
H -3.771311 -3.077898 0.022014
H -5.057309 3.301507 -0.019177
H 0.474560 -3.857044 0.025114
H -6.444390 1.246740 -0.005054
H -1.864723 -4.680513 0.031596
H 1.462861 1.086550 2.153277
H 1.460957 1.058432 -2.168437
H 3.904940 0.529114 2.159319
H 3.903026 0.500919 -2.169376


%chk=000249418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249418

0 1
O 6.159586 0.145415 1.137612
O 6.159134 0.131143 -1.143522
N 5.564517 0.256348 -0.003574
C -1.159678 0.574504 -0.003578
C -2.596420 0.982317 -0.005347
C -1.161311 -0.917225 0.006426
C -3.412419 -0.192544 0.003190
C -2.522412 -1.371885 0.010453
C -0.105179 1.447047 -0.009918
C -3.187153 2.260578 -0.013565
C -0.105931 -1.853472 0.011789
C -4.817592 -0.091062 0.003558
C -2.824450 -2.747174 0.019761
C 1.347487 1.102089 -0.008146
C -4.599722 2.361827 -0.013193
C -0.413254 -3.236375 0.021148
C -5.407106 1.196212 -0.004689
C -1.758853 -3.679676 0.025112
C 2.057050 0.967889 1.217440
C 2.056617 0.952395 -1.232191
C 3.437914 0.689293 1.228916
C 3.437470 0.673635 -1.240599
C 4.108446 0.546739 -0.005110
H -0.328977 2.524223 -0.016915
H -2.575866 3.170396 -0.020215
H 0.938136 -1.529640 0.008781
H -5.448792 -0.986216 0.010073
H -3.862660 -3.096705 0.022809
H -5.074804 3.348842 -0.019554
H 0.399213 -3.970978 0.025342
H -6.498167 1.295497 -0.004527
H -1.974801 -4.753809 0.032368
H 1.516721 1.079073 2.162968
H 1.515989 1.051654 -2.178876
H 3.997464 0.581158 2.161631
H 3.996702 0.553686 -2.172057


