%chk=000221408.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221408

0 1
O 0.399940 1.142224 0.364644
O 2.848760 -0.822435 -2.293684
O 0.793081 -0.382714 -1.780924
O -2.585871 3.015207 -1.457034
O -0.620144 3.090374 -0.551361
O -4.547845 -2.703687 -0.036366
O -5.371488 -0.911401 -0.930200
N 1.977905 -0.491238 -1.512924
N -1.653445 2.522568 -0.846328
N -4.470892 -1.545265 -0.410775
C 1.580773 0.497244 0.781928
C -0.737359 0.405207 0.177997
C 2.386791 -0.221644 -0.115428
C 4.068268 -0.439815 1.631768
C -1.807975 1.121130 -0.416914
C 3.639897 -0.683117 0.319885
C 1.993843 0.753348 2.093196
C 3.237966 0.283217 2.511154
C -0.897942 -0.933258 0.595616
C -3.033410 0.469120 -0.621834
C -3.182399 -0.858142 -0.209547
C -2.113871 -1.562725 0.394702
C 5.399868 -0.923983 2.093824
H 4.280211 -1.227497 -0.386136
H 1.350154 1.332311 2.759964
H 3.573745 0.482711 3.532241
H -0.067346 -1.469114 1.054848
H -3.869463 1.008315 -1.104223
H -2.268664 -2.607420 0.700156
H 6.113570 -0.089072 2.189831
H 5.344300 -1.414085 3.077382
H 5.856740 -1.649964 1.405541


%chk=000221408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221408

0 1
O 0.451092 1.113896 0.190447
O 3.228856 -0.717000 -2.399852
O 1.000235 -0.448363 -2.000664
O -2.611130 2.911731 -1.812187
O -0.978750 3.335404 -0.274427
O -4.654403 -2.730552 0.159975
O -5.546788 -0.838805 -0.757350
N 2.233196 -0.469067 -1.619009
N -1.804905 2.549618 -0.870940
N -4.567709 -1.508771 -0.250568
C 1.620103 0.465123 0.663834
C -0.762048 0.441163 0.114416
C 2.528329 -0.215375 -0.188504
C 4.125719 -0.481862 1.662645
C -1.883245 1.134299 -0.428370
C 3.768768 -0.674657 0.310261
C 1.978404 0.681878 2.009600
C 3.207235 0.203217 2.504815
C -0.922850 -0.902023 0.537861
C -3.126107 0.492772 -0.568831
C -3.255751 -0.834909 -0.126887
C -2.164968 -1.541327 0.428804
C 5.459247 -0.965841 2.198027
H 4.444614 -1.178159 -0.387300
H 1.289889 1.245466 2.646132
H 3.464249 0.375855 3.555912
H -0.063229 -1.442549 0.943268
H -3.972707 1.021785 -1.013879
H -2.306534 -2.575499 0.752758
H 6.129718 -0.112583 2.412997
H 5.334381 -1.527502 3.141116
H 5.974787 -1.620961 1.476897


