%chk=000201543.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201543

0 1
O 2.973376 1.327089 0.153143
O -1.178260 3.459608 0.259958
O -1.978726 0.755527 -1.704414
O -4.048059 -0.678582 -0.849134
N 2.831427 -1.500153 -0.420541
C 0.722823 0.572701 -0.620149
C 1.777381 0.618520 0.537599
C 2.278157 -0.826116 0.803323
C 1.320349 -0.112968 -1.878201
C 1.221342 1.307053 1.801423
C 0.315807 2.027237 -0.932810
C -0.450475 -0.286359 -0.162810
C 1.101232 -1.692432 1.305450
C 2.734331 -0.668007 -1.665103
C -0.255494 -1.336283 0.762551
C 0.696513 2.713372 1.519838
C -0.176312 2.782179 0.280630
C -1.745973 -0.131941 -0.688223
C 4.254683 -1.905625 -0.203405
C -1.336388 -2.115924 1.212893
C -2.828505 -0.912118 -0.212559
C -2.633208 -1.903016 0.742585
C -5.044087 -0.059366 0.009072
H 3.055039 -0.775515 1.609366
H 1.334672 0.584941 -2.735302
H 0.651985 -0.942258 -2.194699
H 2.021904 1.357265 2.566255
H 0.410760 0.695289 2.245835
H -0.472850 2.049064 -1.724588
H 1.170823 2.571710 -1.380357
H 1.078610 -1.671554 2.413487
H 1.313920 -2.754892 1.029263
H 2.995328 -1.336331 -2.515925
H 3.468156 0.171820 -1.665914
H 1.533868 3.431759 1.406699
H 0.121116 3.084550 2.395096
H 2.767194 2.244982 -0.106063
H 4.948646 -1.068317 -0.031066
H 4.603991 -2.469823 -1.082960
H 4.307612 -2.590151 0.657293
H -1.160910 -2.912116 1.934272
H -3.468623 -2.504998 1.093444
H -2.962765 0.761253 -1.935863
H -5.295288 -0.727250 0.836721
H -5.893995 0.060628 -0.672493
H -4.681726 0.906248 0.373082


%chk=000201543-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201543

0 1
O 3.187234 1.401077 0.020193
O -0.992866 3.753186 0.695218
O -1.893624 0.870557 -1.738406
O -3.947373 -0.495706 -0.906460
N 2.465097 -1.472485 -0.469559
C 0.793038 0.825505 -0.530182
C 1.939035 0.782740 0.538541
C 2.296515 -0.697424 0.795039
C 1.322071 0.235492 -1.894180
C 1.545005 1.519589 1.847433
C 0.373421 2.325490 -0.751520
C -0.383901 -0.053478 -0.025793
C 1.152223 -1.342138 1.608257
C 2.544560 -0.699497 -1.727831
C -0.213778 -1.048685 0.991983
C 1.150441 3.000573 1.604185
C 0.064823 3.089215 0.532165
C -1.662740 0.033444 -0.632827
C 3.496239 -2.515469 -0.362154
C -1.312192 -1.826841 1.420543
C -2.759208 -0.751381 -0.180554
C -2.600344 -1.677151 0.861691
C -5.155271 -1.213461 -0.502101
H 3.238035 -0.706437 1.390831
H 1.604759 1.062056 -2.572894
H 0.490679 -0.304791 -2.377228
H 2.400217 1.467592 2.547026
H 0.685312 1.022679 2.326802
H -0.486148 2.387749 -1.432823
H 1.228220 2.839029 -1.244202
H 1.188360 -1.014061 2.666837
H 1.308747 -2.436802 1.617683
H 2.553109 -1.430017 -2.560560
H 3.484154 -0.105165 -1.789600
H 2.033374 3.584014 1.264508
H 0.789565 3.472373 2.533618
H 3.010827 2.352279 -0.193608
H 4.535943 -2.105607 -0.300217
H 3.444404 -3.183764 -1.241486
H 3.322911 -3.133530 0.538319
H -1.152965 -2.580086 2.200907
H -3.435474 -2.286917 1.218531
H -2.859957 0.800883 -1.969669
H -5.025519 -2.305991 -0.624851
H -5.949597 -0.854816 -1.173017
H -5.417960 -0.983122 0.548107


