%chk=000215086.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215086

0 1
O 1.168497 0.925214 -2.485792
O -2.662579 2.932636 -0.835312
N -0.305871 0.315010 -0.707394
N -1.433929 1.009876 -0.129690
N -0.711729 2.222804 -1.945309
C 0.637315 -0.203338 0.356778
C 1.759174 0.773545 0.654817
C 1.127587 -1.587187 -0.036128
C 0.217740 1.146921 -1.783148
C -1.758106 2.154671 -0.977897
C -2.519765 0.165144 0.347209
C 1.570296 1.715210 1.679517
C 1.258346 -2.538002 0.991456
C 2.962461 0.761848 -0.061858
C 1.455579 -1.943429 -1.349498
C -3.566385 0.813974 1.028736
C -2.506816 -1.230837 0.205460
C 2.581478 2.627294 1.988506
C 1.711008 -3.826681 0.703089
C 3.973374 1.675981 0.251379
C 1.902989 -3.238009 -1.634387
C 3.786157 2.607022 1.276685
C 2.031876 -4.181157 -0.612060
C -4.593888 0.047082 1.578965
C -3.543250 -1.979019 0.769856
C -4.584023 -1.346996 1.456487
H 0.017058 -0.321479 1.299642
H -0.627862 2.952734 -2.647883
H 0.631351 1.741579 2.232780
H 1.013497 -2.273202 2.019193
H 3.110061 0.048481 -0.875758
H 1.370078 -1.216002 -2.162011
H -3.581413 1.903458 1.114695
H -1.706996 -1.733936 -0.342221
H 2.431257 3.355561 2.783842
H 1.814088 -4.557036 1.504058
H 4.906929 1.661425 -0.309509
H 2.153070 -3.507083 -2.659954
H 4.574740 3.317246 1.520079
H 2.381743 -5.187047 -0.836116
H -5.409559 0.541928 2.106626
H -3.538267 -3.064231 0.666463
H -5.388410 -1.937271 1.891409


%chk=000215086-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215086

0 1
O 1.471349 0.647393 -2.559088
O -2.523787 2.899878 -1.403590
N -0.225373 0.223913 -0.917696
N -1.399607 0.967512 -0.520809
N -0.478820 2.001611 -2.268295
C 0.602314 -0.395513 0.188491
C 1.576512 0.621848 0.792388
C 1.215945 -1.728532 -0.259547
C 0.386846 0.922632 -1.995212
C -1.580822 2.074887 -1.390707
C -2.440396 0.342913 0.238986
C 1.166510 1.380958 1.917560
C 2.170603 -2.354948 0.581945
C 2.858813 0.854397 0.230425
C 0.789193 -2.401273 -1.428999
C -3.353480 1.160797 0.952041
C -2.563130 -1.070516 0.270802
C 2.019418 2.359384 2.475373
C 2.688673 -3.627156 0.258046
C 3.709810 1.832576 0.787383
C 1.311396 -3.672417 -1.756349
C 3.295021 2.587556 1.909967
C 2.261157 -4.292826 -0.914167
C -4.391781 0.553973 1.688939
C -3.596572 -1.659713 1.029784
C -4.515963 -0.854308 1.739981
H -0.145515 -0.632176 0.970045
H -0.312622 2.678162 -3.010836
H 0.178223 1.202822 2.361049
H 2.511477 -1.844196 1.489739
H 3.177888 0.276493 -0.642404
H 0.066585 -1.920476 -2.095260
H -3.258618 2.248144 0.905602
H -1.875390 -1.696971 -0.306347
H 1.692769 2.936172 3.347676
H 3.426172 -4.096720 0.918556
H 4.696688 2.006803 0.344643
H 0.980143 -4.173638 -2.672668
H 3.960324 3.343966 2.341346
H 2.666633 -5.278216 -1.169226
H -5.102527 1.187337 2.230589
H -3.687467 -2.751046 1.053288
H -5.319695 -1.316785 2.322360


