%chk=000202977.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202977

0 1
O 3.934930 -0.762962 0.097861
N -3.917951 -0.151454 -0.062517
N -0.820367 2.040284 -0.095288
C -1.812633 -1.519629 0.236894
C -1.083764 -0.223610 0.121120
C -1.750306 0.993448 0.011515
C -3.259451 -1.236357 0.732483
C 0.325838 0.045018 0.072525
C -3.229797 1.178619 0.039848
C 0.473009 1.470253 -0.065892
C -1.818954 -2.260471 -1.104783
C 1.472493 -0.770320 0.134170
C 1.737186 2.087370 -0.143541
C 2.702436 -0.136176 0.055327
C 2.852907 1.278548 -0.082202
C 3.949536 -2.203432 0.226484
H -1.307429 -2.161117 1.002434
H -3.879193 -2.149777 0.601013
H -3.226672 -1.012172 1.819915
H -3.519821 1.752635 0.949737
H -3.568960 1.768877 -0.846247
H -4.883438 -0.040345 0.269209
H -1.024026 3.010961 -0.210057
H -0.804674 -2.359463 -1.506220
H -2.253532 -3.259029 -1.016069
H -2.409845 -1.703620 -1.846611
H 1.363068 -1.842282 0.236264
H 1.825716 3.164972 -0.248760
H 3.860202 1.685782 -0.136604
H 5.025458 -2.419190 0.230029
H 3.459251 -2.666893 -0.634478
H 3.485484 -2.505369 1.169739


%chk=000202977-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202977

0 1
O 3.994518 -0.778465 0.072320
N -3.870846 -0.145893 -0.107262
N -0.827206 2.055963 -0.072398
C -1.820324 -1.525151 0.251966
C -1.087130 -0.206645 0.127219
C -1.757714 1.011945 0.035496
C -3.270708 -1.217817 0.725282
C 0.332351 0.083698 0.068042
C -3.251973 1.187783 0.071409
C 0.468185 1.511314 -0.055161
C -1.813867 -2.325268 -1.077674
C 1.498136 -0.730732 0.116085
C 1.731640 2.135767 -0.135814
C 2.756163 -0.098462 0.036655
C 2.875036 1.319069 -0.089815
C 3.948453 -2.232083 0.202344
H -1.336471 -2.142622 1.038321
H -3.898156 -2.121863 0.619562
H -3.241524 -0.945625 1.809992
H -3.543496 1.683528 1.035367
H -3.593825 1.850697 -0.749442
H -4.894101 -0.113918 -0.044129
H -1.051344 3.043225 -0.171181
H -0.787820 -2.435246 -1.472590
H -2.240554 -3.336791 -0.935366
H -2.418405 -1.789532 -1.830263
H 1.405798 -1.816500 0.213357
H 1.834268 3.222430 -0.231167
H 3.880245 1.746695 -0.148375
H 4.999769 -2.556870 0.212255
H 3.422612 -2.700098 -0.653993
H 3.454992 -2.539436 1.146254


