%chk=000255678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255678

0 1
O 3.153663 0.565533 0.938815
O 4.051737 -1.157320 -0.209433
O -2.576742 -0.524020 1.621265
O -4.876572 1.333943 0.122734
O -2.136559 1.697722 1.665510
O -4.455121 0.953790 -2.042416
N 0.078088 -1.426575 -1.817425
C 0.581508 0.205375 -0.297583
C 1.744267 -0.600315 -0.533204
C -0.460700 -0.319434 -1.086898
C 1.397859 -1.611132 -1.465664
C 0.529391 1.392647 0.564540
C 2.224295 -2.697961 -2.017039
C -1.821508 0.078773 -1.317748
C 3.075459 -0.469722 0.030070
C -2.705104 0.570389 -0.418514
C 4.456440 0.827012 1.552752
C -2.438571 0.714028 1.034726
C -4.045502 0.954295 -0.901092
C 5.327425 1.608734 0.591432
C -2.363643 -0.587884 3.058027
H -0.463559 -2.004036 -2.436590
H 0.294599 1.129397 1.611583
H 1.505534 1.913056 0.604219
H -0.227331 2.130537 0.253233
H 1.867374 -3.694895 -1.718247
H 2.290594 -2.672710 -3.114195
H 3.271281 -2.617754 -1.638169
H -2.171591 -0.047408 -2.362648
H 4.151539 1.410126 2.440504
H 4.908807 -0.136623 1.848460
H 6.248801 1.954244 1.073979
H 5.617490 0.989313 -0.270962
H 4.804003 2.488379 0.196010
H -5.779250 1.604083 -0.204790
H -2.755777 -1.578159 3.312860
H -2.917901 0.212374 3.560460
H -1.291624 -0.507803 3.259339


%chk=000255678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255678

0 1
O 3.251756 0.330274 1.036001
O 4.125501 -1.188304 -0.507491
O -2.317672 -0.203769 1.802159
O -5.162844 1.003389 -0.127233
O -2.903453 2.027409 1.474621
O -4.452405 0.450527 -2.268601
N 0.110308 -1.339711 -1.915093
C 0.570538 0.083904 -0.197059
C 1.768436 -0.627382 -0.582050
C -0.477056 -0.390099 -1.034639
C 1.444400 -1.513430 -1.652390
C 0.459318 1.186762 0.818533
C 2.290745 -2.486892 -2.415352
C -1.871076 -0.096855 -1.227052
C 3.138028 -0.542621 -0.056645
C -2.843986 0.471794 -0.424767
C 4.622254 0.484658 1.613197
C -2.696797 0.884856 1.006846
C -4.177074 0.643505 -1.054092
C 5.410594 1.563319 0.864374
C -2.219062 0.084090 3.254802
H -0.413805 -1.862376 -2.617305
H 0.322786 0.776171 1.836579
H 1.384178 1.782464 0.844504
H -0.390667 1.853131 0.602068
H 2.727476 -3.243438 -1.740367
H 1.705315 -3.000379 -3.199312
H 3.149382 -1.975282 -2.882814
H -2.261170 -0.379019 -2.220333
H 4.430182 0.765375 2.661392
H 5.135864 -0.491340 1.565884
H 6.386067 1.725053 1.359961
H 5.600977 1.255550 -0.177337
H 4.862883 2.521722 0.860733
H -6.028467 1.107008 -0.605813
H -1.848263 -0.849539 3.700264
H -3.214021 0.347218 3.651477
H -1.526072 0.922256 3.440248


