%chk=000206988.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206988

0 1
O -0.234655 -0.064925 0.209127
O -0.442549 -0.129450 -2.064846
O 1.280157 -3.118896 2.330195
O -0.464897 -2.070384 1.611388
N 1.475445 1.806905 -1.062564
N 0.741787 -2.213045 1.711584
C 2.014941 0.747548 -0.346863
C 3.414066 0.574637 -0.173385
C 1.115673 -0.203954 0.269275
C 1.621072 -1.238657 1.051700
C 3.903720 -0.509116 0.622720
C 3.036172 -1.379195 1.223152
C 4.280090 1.524085 -0.806892
C -2.349595 0.434242 -0.626436
C -4.223605 0.241222 0.897816
C -2.896257 -0.069815 0.559173
C -0.965361 0.093503 -1.015279
C 3.740314 2.556961 -1.528752
C -3.103783 1.250862 -1.484486
C 2.311430 2.669784 -1.627448
C -4.977865 1.059848 0.043026
C -4.419556 1.560441 -1.138563
C -4.809281 -0.288943 2.164025
H 4.981091 -0.623616 0.744010
H 3.392313 -2.210535 1.845172
H 5.359326 1.405767 -0.701781
H -2.283091 -0.704287 1.213422
H 4.365613 3.295910 -2.028121
H -2.664615 1.632884 -2.406641
H -6.007539 1.308955 0.298771
H 1.865796 3.500779 -2.190698
H -5.017195 2.193924 -1.793533
H -4.506312 -1.330280 2.351822
H -4.470835 0.301625 3.029428
H -5.906612 -0.270184 2.166584


%chk=000206988-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206988

0 1
O -0.207925 -0.241746 0.329073
O -0.421513 -0.252444 -2.006784
O 1.576933 -3.593315 1.888024
O -0.130166 -2.967664 0.509567
N 1.339800 1.906691 -0.483096
N 1.024175 -2.778620 1.046504
C 1.988895 0.740699 -0.112738
C 3.429236 0.614755 -0.081870
C 1.176579 -0.390512 0.260983
C 1.805525 -1.576878 0.669928
C 4.026147 -0.612363 0.354801
C 3.229105 -1.684323 0.738449
C 4.195493 1.755367 -0.488580
C -2.374958 0.221920 -0.610202
C -4.228571 0.674315 0.946319
C -2.865194 0.375453 0.710509
C -0.955502 -0.093921 -0.896115
C 3.535615 2.920813 -0.880572
C -3.250646 0.362749 -1.719072
C 2.102649 2.950740 -0.853662
C -5.091880 0.809921 -0.172153
C -4.608117 0.657436 -1.493372
C -4.746746 0.860160 2.361663
H 5.117653 -0.699219 0.383627
H 3.656280 -2.626407 1.091035
H 5.289660 1.698131 -0.485373
H -2.174517 0.255805 1.550546
H 4.088909 3.809212 -1.199460
H -2.852143 0.235461 -2.730695
H -6.152717 1.034072 -0.005917
H 1.565837 3.860890 -1.144985
H -5.293317 0.763948 -2.341079
H -4.309957 0.116848 3.051968
H -4.483955 1.862345 2.751810
H -5.845265 0.764282 2.407022


