%chk=000296456.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296456

0 1
O -3.110751 -0.859428 0.787600
O 1.088227 -2.975638 -1.805817
N -1.162193 0.064968 0.070690
N -0.142594 0.893716 0.460347
N 2.329719 0.816898 0.124744
N 2.915269 -1.722352 -1.379247
N 2.566446 1.653526 1.065154
N 3.725595 2.306397 1.040952
C -2.565295 0.422615 0.401590
C -3.294178 0.995288 -0.823274
C -4.797329 1.079376 -0.537280
C -5.332628 -0.289010 -0.098581
C -4.526183 -0.825188 1.084101
C -0.698570 -1.058761 -0.594896
C 0.700732 -0.941093 -0.657282
C 1.015210 0.295826 0.019553
C 1.543302 -1.947293 -1.313047
C 4.115381 2.886753 2.353512
C 4.844181 1.992769 0.113537
H -2.585156 1.110268 1.283793
H -3.114704 0.357793 -1.713255
H -2.880671 1.991069 -1.076940
H -5.332209 1.425248 -1.443021
H -4.999049 1.839952 0.242014
H -6.403553 -0.221545 0.168914
H -5.272132 -1.002890 -0.945239
H -4.674949 -0.228139 2.000706
H -4.726552 -1.893503 1.291724
H -1.332793 -1.854470 -0.962696
H 3.351543 -0.882127 -1.036751
H 3.502308 -2.394116 -1.844848
H 3.225676 3.047090 2.993490
H 4.583765 3.870981 2.180664
H 4.819002 2.240273 2.903286
H 5.588651 2.802647 0.132017
H 4.457628 1.912454 -0.921043
H 5.341556 1.040547 0.359727


%chk=000296456-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296456

0 1
O -3.106676 -1.019007 0.752939
O 1.214126 -2.719279 -2.409620
N -1.118239 -0.040867 -0.004588
N -0.102108 0.753206 0.532550
N 2.358426 0.674403 0.206490
N 2.994077 -1.468953 -1.550047
N 2.459139 1.735534 0.984355
N 3.741303 2.131648 1.185739
C -2.503494 0.259844 0.348106
C -3.290135 0.895869 -0.818221
C -4.768016 1.101275 -0.408724
C -5.379438 -0.234669 0.075234
C -4.507648 -0.837266 1.192284
C -0.652062 -1.025854 -0.845409
C 0.743451 -0.895578 -0.887619
C 1.039072 0.222992 -0.021263
C 1.650103 -1.771084 -1.679071
C 3.915224 3.309495 2.041247
C 4.894732 1.430168 0.598615
H -2.455694 0.957501 1.209856
H -3.228660 0.223218 -1.695033
H -2.811967 1.854420 -1.092116
H -5.343920 1.510024 -1.258625
H -4.824623 1.850751 0.407804
H -6.408358 -0.083253 0.454751
H -5.434641 -0.948761 -0.768586
H -4.525328 -0.180385 2.090572
H -4.837937 -1.847754 1.482152
H -1.296289 -1.756386 -1.324949
H 3.266930 -0.683580 -0.939368
H 3.669663 -2.031542 -2.063887
H 2.915101 3.643626 2.354895
H 4.417496 4.128674 1.492888
H 4.514798 3.064478 2.938274
H 5.817120 1.936209 0.922867
H 4.834217 1.438142 -0.505957
H 4.912955 0.373641 0.926362


