%chk=000184570.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184570

0 1
O -4.173839 2.364266 0.472141
O -2.289196 2.730299 -0.514916
O 4.400521 2.289363 0.058623
O 4.815705 0.172185 0.029034
N -3.121275 1.990756 -0.016892
N 4.048277 1.120105 0.036662
C 0.679514 -0.575369 -0.004056
C -0.221985 0.552519 -0.012280
C -0.036522 -1.826002 -0.013562
C -1.588275 -0.022651 -0.022949
C -1.467644 -1.467413 -0.020839
C 2.074718 -0.485295 0.009636
C 0.315501 1.813200 -0.007122
C -2.860821 0.531169 -0.014224
C 0.668536 -2.998362 -0.011158
C 2.589688 0.857062 0.018972
C -2.581483 -2.284584 -0.017725
C 2.784972 -1.731609 0.012261
C 1.736457 1.950056 0.010714
C 2.100644 -2.925335 0.001761
C -4.001816 -0.312160 0.002350
C -3.861430 -1.690856 -0.005280
H -0.301526 2.719244 -0.027006
H 0.183564 -3.971870 -0.018815
H -2.481227 -3.370501 -0.021283
H 3.881696 -1.713220 0.022000
H 2.157948 2.966750 0.015887
H 2.655112 -3.866575 0.003180
H -4.997326 0.147199 0.027798
H -4.747189 -2.329072 0.002287


%chk=000184570-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184570

0 1
O -4.465649 2.333522 0.186698
O -2.285217 2.823715 -0.201166
O 4.478783 2.373039 0.029565
O 4.931997 0.146538 0.026227
N -3.239141 1.978176 -0.002971
N 4.100996 1.137533 0.022049
C 0.689283 -0.561224 -0.007784
C -0.207441 0.569156 -0.015953
C -0.037402 -1.788527 -0.011195
C -1.594511 0.011043 -0.017850
C -1.468938 -1.434415 -0.014628
C 2.113596 -0.496966 0.001677
C 0.370444 1.849638 -0.015963
C -2.918988 0.528226 -0.002367
C 0.653095 -3.002283 -0.008137
C 2.642737 0.847806 0.008321
C -2.583208 -2.288621 -0.007602
C 2.808461 -1.759825 0.004794
C 1.790270 1.965440 0.001425
C 2.084657 -2.962734 -0.000599
C -4.047733 -0.333727 0.012062
C -3.883167 -1.729577 0.004845
H -0.239220 2.750188 -0.034303
H 0.134516 -3.966953 -0.011107
H -2.449257 -3.375131 -0.008939
H 3.898090 -1.772973 0.011689
H 2.250522 2.957151 0.005168
H 2.638898 -3.907359 0.001780
H -5.040993 0.120749 0.029301
H -4.764183 -2.378310 0.010160


