%chk=000225412.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225412

0 1
O -4.019754 -2.916540 -1.812016
O -5.212032 1.153280 0.271178
N 5.356025 -0.008347 0.142179
N -0.286248 0.434693 0.159970
N -2.909011 1.169169 0.467087
C 3.947819 0.176456 0.088517
C 1.125920 0.268449 0.118454
C -1.155179 -0.481045 -0.131592
C 3.195540 -0.310830 -1.008311
C 3.251759 0.731489 1.192211
C -2.618436 -0.089495 -0.110232
C 1.806334 -0.272402 -0.989146
C 1.864438 0.783590 1.203751
C -0.877081 -1.893345 -0.489668
C 6.059571 -0.196398 -1.156143
C 6.116361 0.887577 1.056223
C -3.549120 -0.914837 -0.637764
C -1.814872 -2.701592 -0.988931
C -3.223464 -2.228451 -1.209896
C -4.208402 1.733763 0.618108
C -4.188876 3.096036 1.249716
H 3.698115 -0.731380 -1.877554
H 3.801250 1.115787 2.050055
H 1.244398 -0.640243 -1.848658
H 1.339499 1.217748 2.055795
H 0.145448 -2.236991 -0.305198
H 6.013381 0.683505 -1.816985
H 5.627926 -1.061816 -1.689911
H 7.119440 -0.436888 -0.968822
H 5.719874 0.793616 2.082976
H 6.085250 1.948784 0.763173
H 7.170621 0.566018 1.092996
H -4.617042 -0.648899 -0.666599
H -2.095441 1.725467 0.770144
H -1.628495 -3.741896 -1.259838
H -5.220187 3.480001 1.339409
H -3.627583 3.829822 0.654689
H -3.764447 3.086147 2.263034


%chk=000225412-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225412

0 1
O -4.274402 -3.102658 -1.686344
O -5.168083 1.348234 0.292491
N 5.309675 0.368909 0.047811
N -0.361266 0.273694 0.267035
N -2.844543 1.063792 0.431091
C 3.918123 0.332672 0.079318
C 1.031086 0.227844 0.158559
C -1.235814 -0.613456 -0.219162
C 3.164018 -0.276143 -0.980128
C 3.180577 0.928503 1.158128
C -2.669019 -0.202872 -0.147319
C 1.766244 -0.338533 -0.933693
C 1.782956 0.895537 1.174726
C -0.942932 -1.951311 -0.737871
C 6.042668 -0.252404 -1.066145
C 6.057021 1.047771 1.117856
C -3.674715 -1.015372 -0.643308
C -1.944667 -2.768845 -1.197024
C -3.364810 -2.330236 -1.211667
C -4.028910 1.774894 0.638497
C -3.819294 3.125271 1.322570
H 3.676449 -0.683968 -1.855520
H 3.705851 1.426419 1.977046
H 1.227990 -0.765754 -1.785997
H 1.229328 1.365341 1.994289
H 0.089237 -2.311703 -0.688415
H 5.822281 0.243481 -2.032971
H 5.794128 -1.327067 -1.165149
H 7.124871 -0.171121 -0.882392
H 5.864264 0.586158 2.106660
H 5.795415 2.122606 1.182219
H 7.136092 0.973255 0.914101
H -4.717392 -0.693855 -0.618414
H -1.938168 1.467228 0.725351
H -1.747595 -3.788229 -1.547709
H -4.793313 3.625169 1.422041
H -3.141728 3.770580 0.733518
H -3.378323 2.996171 2.328325


