%chk=000219076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219076

0 1
O -0.094082 -1.388910 -1.184574
O -1.888317 2.223093 0.148992
N -2.249384 -1.295564 0.657405
C -1.964756 -0.082534 -0.178596
C -3.551451 -1.144239 1.401158
C -2.413716 -2.573475 -0.110985
C -4.655854 -1.870272 0.600070
C -3.916949 -2.768184 -0.408340
C -1.005736 -0.289353 -1.374237
C -1.404381 1.003245 0.769117
C 1.336688 -1.142249 -1.173945
C -1.282396 3.444254 0.606071
C 0.125469 3.700211 0.022456
C 1.799556 -0.698198 0.209758
C 1.886120 -2.544201 -1.485471
C 1.213663 3.033561 0.867714
C 0.198490 3.246874 -1.437379
C 1.712331 -0.194176 -2.221600
C 2.989628 0.024283 0.371279
C 1.062493 -1.085738 1.336743
C 3.432092 0.364904 1.653045
C 1.505572 -0.740347 2.615841
C 2.691085 -0.015855 2.776346
C 2.022291 0.570703 -3.098754
H -2.912373 0.337754 -0.630652
H -3.807184 -0.086330 1.591416
H -3.403042 -1.625604 2.390621
H -2.037583 -3.381611 0.553219
H -1.792359 -2.612844 -1.025096
H -5.305302 -2.459688 1.266253
H -5.310424 -1.149519 0.083625
H -4.155570 -2.478837 -1.444741
H -4.209902 -3.824370 -0.304032
H -1.570197 -0.595967 -2.276303
H -0.473704 0.665642 -1.589175
H -1.814732 0.948540 1.789923
H -0.298915 1.006767 0.821001
H -2.009035 4.186372 0.220776
H -1.280437 3.470719 1.707786
H 0.294270 4.807839 0.055788
H 1.499765 -3.272816 -0.759829
H 2.979756 -2.562992 -1.441676
H 1.568842 -2.879386 -2.480203
H 1.070796 1.940148 0.917066
H 1.221502 3.409947 1.894724
H 2.209797 3.203632 0.445928
H -0.042771 2.171202 -1.526986
H 1.195111 3.401031 -1.859825
H -0.525140 3.784802 -2.058379
H 3.573986 0.322800 -0.498167
H 0.127958 -1.646908 1.201438
H 4.356450 0.925499 1.775411
H 0.926128 -1.040956 3.486947
H 3.037962 0.248557 3.773060
H 2.287992 1.227642 -3.851033


%chk=000219076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219076

0 1
O 0.119105 -1.604766 -0.019337
O -0.748012 1.352635 1.725995
N -2.873869 -1.420248 0.282754
C -1.921008 -0.269358 0.191309
C -4.302619 -0.995054 0.356748
C -2.875820 -2.430938 -0.808634
C -4.867042 -1.022642 -1.114932
C -3.820926 -1.864288 -1.917092
C -0.657415 -0.516908 -0.644632
C -1.540300 0.116634 1.646897
C 1.400017 -1.946961 -0.698892
C -1.560276 2.578220 1.713224
C -0.629773 3.793954 1.893491
C 2.392238 -0.761901 -0.666042
C 1.947409 -3.118900 0.156492
C 0.127427 3.722510 3.240316
C 0.345426 3.935438 0.700647
C 1.122733 -2.416020 -2.080780
C 3.324815 -0.540532 -1.707505
C 2.417849 0.076519 0.476884
C 4.280274 0.496554 -1.603588
C 3.366310 1.116962 0.575689
C 4.305939 1.327542 -0.460642
C 0.856850 -2.845107 -3.205203
H -2.407650 0.613950 -0.294429
H -4.391221 -0.001054 0.829483
H -4.861282 -1.715532 0.984342
H -3.307946 -3.365289 -0.397570
H -1.856003 -2.663344 -1.146196
H -5.869203 -1.486670 -1.139981
H -4.965258 -0.004400 -1.531430
H -3.249749 -1.217893 -2.609507
H -4.290331 -2.664156 -2.516972
H -0.909120 -0.784313 -1.690710
H -0.061837 0.417126 -0.649641
H -2.460007 0.204910 2.262478
H -0.907852 -0.682184 2.064710
H -2.116797 2.667057 0.753187
H -2.301865 2.533803 2.543264
H -1.293234 4.685606 1.910802
H 2.098331 -2.767609 1.190871
H 2.910615 -3.473774 -0.246448
H 1.222146 -3.949207 0.160326
H 0.760515 2.818646 3.272230
H -0.574258 3.674945 4.094598
H 0.772401 4.610213 3.376210
H 0.990635 3.043168 0.622984
H 0.991859 4.823974 0.824687
H -0.201930 4.044477 -0.255181
H 3.301216 -1.175772 -2.600132
H 1.676851 -0.069453 1.270069
H 4.999053 0.656743 -2.415312
H 3.368801 1.764246 1.460066
H 5.043927 2.133776 -0.381188
H 0.629961 -3.216440 -4.187779


