%chk=000234074.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234074

0 1
O -2.344277 -1.402758 -0.104236
N -1.189724 0.586315 0.051098
N 4.120297 -1.304747 0.006734
N 3.477363 2.886885 0.086732
C -4.877409 -0.259630 -0.038665
C -6.170204 0.560518 0.023805
C -3.637120 0.640646 0.048110
C -7.406303 -0.346330 -0.064037
C -2.370586 -0.193284 -0.011599
C 2.541650 0.595847 0.014173
C 0.157507 0.097842 0.024358
C 2.827065 -0.796539 0.005189
C 1.185422 1.027466 0.028824
C -8.702067 0.458650 -0.002743
C 3.676026 1.498048 0.014112
C 0.444605 -1.306783 0.000944
C 1.741812 -1.738028 -0.006332
C 4.961531 0.975316 0.009493
C 5.143680 -0.441688 0.016148
C 6.527529 -1.006950 0.026285
H -4.839724 -0.855929 -0.973543
H -4.851634 -1.008131 0.780079
H -6.205191 1.147929 0.961459
H -6.192876 1.301731 -0.798044
H -3.652344 1.379655 -0.778984
H -3.665873 1.227956 0.989092
H -7.375717 -0.935426 -1.002006
H -7.387970 -1.089044 0.758069
H -1.279989 1.600500 0.127084
H 0.973350 2.092889 0.057887
H -8.784020 1.023794 0.932598
H -9.577713 -0.197840 -0.065352
H -8.772505 1.176531 -0.827710
H -0.386333 -2.024741 -0.010105
H 1.990040 -2.802689 -0.019179
H 5.835552 1.616393 0.014850
H 6.518887 -2.109991 0.020783
H 7.098129 -0.681339 -0.853839
H 7.077892 -0.691152 0.923349
H 2.587305 3.251045 -0.215663
H 4.256836 3.479459 -0.156118


%chk=000234074-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234074

0 1
O -2.400021 -1.622070 -0.073270
N -1.184923 0.390303 -0.012457
N 4.231562 -1.301910 -0.015793
N 3.396447 2.891449 0.065495
C -4.933498 -0.309011 -0.007263
C -6.195525 0.581101 -0.012107
C -3.633805 0.517338 -0.035347
C -7.508072 -0.235495 0.011657
C -2.368128 -0.358020 -0.041695
C 2.559688 0.563001 0.012597
C 0.169199 -0.053184 -0.014772
C 2.921309 -0.837832 -0.014128
C 1.180539 0.924512 0.011767
C -8.769770 0.654182 0.010069
C 3.647159 1.525071 0.038913
C 0.523240 -1.443704 -0.041581
C 1.869021 -1.807183 -0.040727
C 4.964717 1.030342 0.036681
C 5.218730 -0.376416 0.009243
C 6.646002 -0.887715 0.008451
H -4.947624 -0.992069 -0.877273
H -4.932454 -0.959166 0.888033
H -6.176921 1.262154 0.865310
H -6.190441 1.232513 -0.911928
H -3.625315 1.168625 -0.934775
H -3.602405 1.196876 0.842242
H -7.529558 -0.913850 -0.865269
H -7.513695 -0.888125 0.908170
H -1.309673 1.405774 0.012291
H 0.880310 1.982008 0.031890
H -8.786533 1.320358 0.893556
H -9.693424 0.047053 0.027697
H -8.803104 1.293768 -0.892381
H -0.271497 -2.190793 -0.061701
H 2.166425 -2.860045 -0.060514
H 5.813357 1.724512 0.055992
H 6.639386 -1.987950 -0.024769
H 7.208728 -0.507684 -0.865234
H 7.189655 -0.562323 0.915742
H 2.453832 3.265893 0.066402
H 4.169978 3.550108 0.083886


