%chk=000246216.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246216

0 1
O 1.797000 -2.790367 -0.125538
N -0.353038 -1.050840 -0.040895
N 0.945879 -0.623756 -0.016640
C -1.342832 -0.196974 -0.012247
C -2.718798 -0.755408 -0.055368
C -1.215604 1.285895 0.056607
C -3.767546 -0.075565 0.587422
C -0.823244 1.901658 1.254097
C -2.980604 -1.958135 -0.732694
C -1.484799 2.060837 -1.079939
C -5.063341 -0.594175 0.546248
C -0.697302 3.292166 1.309553
C -4.280308 -2.469824 -0.769007
C -1.354655 3.451080 -1.017524
C 3.336685 -0.943750 -0.025138
C -5.322864 -1.789774 -0.132481
C -0.960410 4.067068 0.174820
C 1.986543 -1.601885 -0.066516
C 4.145767 -1.129299 1.102661
C 3.795076 -0.197527 -1.117696
C 5.418775 -0.552763 1.139126
C 5.070531 0.372694 -1.075672
C 5.879976 0.197435 0.052144
H -3.572117 0.854715 1.120043
H -0.628500 1.296739 2.139405
H -2.164949 -2.498162 -1.219053
H -1.800415 1.577814 -2.004778
H -5.873499 -0.066049 1.045992
H -0.396271 3.772987 2.239357
H -4.478160 -3.403785 -1.292941
H -1.564423 4.055254 -1.899294
H -6.334105 -2.190680 -0.162567
H -0.861596 5.150512 0.220906
H 1.181926 0.376271 0.044671
H 3.786835 -1.727207 1.941782
H 3.166933 -0.071064 -1.999633
H 6.053181 -0.693670 2.013466
H 5.435028 0.950721 -1.923862
H 6.874048 0.643115 0.082084


%chk=000246216-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246216

0 1
O 1.804758 -2.756396 0.368612
N -0.426909 -1.091887 0.078822
N 0.869400 -0.617055 0.105757
C -1.426432 -0.216903 0.027614
C -2.797817 -0.782899 -0.067256
C -1.220432 1.273892 0.044867
C -3.944656 0.043680 0.090633
C -0.638117 1.910822 1.175420
C -2.984488 -2.176254 -0.305401
C -1.578677 2.065753 -1.079075
C -5.243044 -0.506209 0.009642
C -0.421825 3.307739 1.180850
C -4.280295 -2.719079 -0.384803
C -1.355279 3.460462 -1.075192
C 3.307242 -0.860714 0.121859
C -5.418037 -1.887622 -0.229875
C -0.776798 4.085784 0.054579
C 1.950544 -1.515178 0.200917
C 4.400620 -1.578690 0.672267
C 3.545230 0.396779 -0.496117
C 5.702627 -1.040030 0.632472
C 4.851035 0.932937 -0.539307
C 5.931365 0.220562 0.030745
H -3.821921 1.113822 0.288747
H -0.381985 1.314471 2.059162
H -2.098354 -2.807909 -0.418363
H -2.030408 1.583300 -1.952997
H -6.116168 0.143444 0.137504
H 0.017496 3.785696 2.063252
H -4.408251 -3.791596 -0.569287
H -1.635608 4.057988 -1.949647
H -6.425608 -2.313461 -0.294461
H -0.608842 5.168332 0.058466
H 1.051825 0.396420 0.091920
H 4.201347 -2.558839 1.117709
H 2.732454 0.948536 -0.984320
H 6.538263 -1.600292 1.065761
H 5.027082 1.898153 -1.026648
H 6.943468 0.638745 -0.003926


