%chk=000186937.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186937

0 1
O 1.477599 1.075845 0.393106
O 2.971289 0.390013 1.956781
N -1.048892 2.454366 0.294526
N 3.516590 0.102841 -0.303014
N -3.283105 0.773471 -0.130217
N -1.930798 -1.181794 -0.112876
N 0.475053 -1.025796 0.132859
C -0.876913 1.025926 0.174044
C -2.044908 0.205847 -0.018310
C 0.346275 0.334971 0.242848
C 2.710149 0.396845 0.784098
C -0.773787 2.920416 1.688785
C 4.674938 -0.790138 -0.039390
C 2.944189 0.020039 -1.667208
C -0.693139 -1.720620 -0.028529
C -4.518893 -0.019312 -0.265151
H -0.394993 2.922236 -0.349543
H -3.372167 1.785819 -0.029629
H -1.469938 2.433091 2.389011
H -0.949515 4.005725 1.734752
H 0.252331 2.712730 2.037184
H 4.428260 -1.853936 -0.194317
H 5.026141 -0.666731 1.003405
H 5.505082 -0.511281 -0.709959
H 2.373425 -0.912796 -1.827801
H 3.755817 0.077018 -2.410534
H 2.264152 0.874364 -1.840468
H -0.614199 -2.818387 -0.099420
H -4.334625 -0.963513 -0.816750
H -5.277191 0.559189 -0.816326
H -4.922826 -0.297149 0.725141


%chk=000186937-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186937

0 1
O 1.314311 0.009520 -0.896491
O 1.971445 0.162191 1.372816
N -0.608630 1.973391 0.109382
N 3.558114 0.008126 -0.356594
N -3.263554 1.064311 0.343596
N -2.622454 -1.175166 -0.131104
N -0.324464 -1.686463 -0.747494
C -0.924584 0.603393 -0.120382
C -2.288213 0.144242 0.034991
C -0.015163 -0.377547 -0.550294
C 2.285557 0.052083 0.160542
C -0.545827 2.411407 1.538146
C 4.697982 0.151241 0.563975
C 3.868074 -0.208675 -1.779374
C -1.619016 -2.021258 -0.494249
C -4.685898 0.731898 0.459244
H 0.230940 2.256818 -0.410340
H -2.969896 2.042145 0.267965
H -1.495795 2.168479 2.044732
H -0.405689 3.505660 1.572361
H 0.277284 1.910198 2.083728
H 5.319886 -0.764087 0.552836
H 4.317671 0.313001 1.583330
H 5.328736 1.010594 0.266348
H 4.581452 -1.048455 -1.880719
H 4.327131 0.696493 -2.222728
H 2.948005 -0.450303 -2.326388
H -1.885276 -3.076101 -0.607923
H -4.773293 -0.360461 0.559544
H -5.255475 1.042620 -0.438988
H -5.127958 1.220005 1.346627


