%chk=000216976.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216976

0 1
I 0.854164 0.212948 3.040773
I -0.272692 -1.578732 -2.815474
I 4.274582 1.893987 -1.682973
O -2.850735 -1.935853 0.700591
O 2.875373 1.442387 1.643905
O -5.409115 2.045947 -0.888493
O -3.369521 2.895766 -0.542906
N -0.630138 -1.492069 0.538778
C -0.271211 -2.795931 1.185579
C 0.459709 -0.678812 0.075349
C -1.989844 -1.146174 0.359950
C -2.270037 0.239996 -0.178674
C 1.219176 0.060827 0.980851
C -3.775558 0.483745 -0.247986
C 0.799582 -0.600233 -1.296444
C 0.130639 -3.849968 0.162613
C 2.330770 0.838366 0.556492
C 1.888752 0.157777 -1.714693
C 2.672548 0.874715 -0.800736
C -4.077356 1.916883 -0.554726
C 4.013415 2.341895 1.537382
H 0.549786 -2.616823 1.916712
H -1.165266 -3.137812 1.763965
H -1.814292 0.374590 -1.187151
H -1.782875 1.010007 0.466017
H -4.268234 0.190985 0.712395
H -4.253563 -0.188414 -0.999056
H -0.674593 -4.033633 -0.563311
H 1.017923 -3.557522 -0.411729
H 0.351580 -4.804705 0.653680
H 2.142803 0.194834 -2.785331
H 4.895904 1.800309 1.184947
H 4.130110 2.642282 2.588572
H 3.764595 3.203674 0.911232
H -5.665783 2.985060 -1.088498


%chk=000216976-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216976

0 1
I 0.952914 -0.030801 2.939004
I -0.110455 -1.820513 -2.912074
I 4.704989 1.681029 -1.611089
O -2.698086 -1.809827 0.899047
O 3.404710 1.348102 1.367649
O -5.029858 2.320750 -0.941416
O -3.093575 2.989236 0.146842
N -0.440907 -1.595200 0.413698
C -0.175751 -2.914486 1.074214
C 0.671683 -0.819629 -0.053817
C -1.756044 -1.105075 0.427320
C -1.975095 0.320951 -0.088233
C 1.465538 -0.062085 0.858634
C -3.464184 0.590866 -0.355711
C 1.048135 -0.788597 -1.427574
C -0.468900 -4.137794 0.185280
C 2.602539 0.681524 0.438793
C 2.178194 -0.067766 -1.868633
C 2.952271 0.653373 -0.937311
C -3.787682 2.068153 -0.341524
C 3.061523 2.772031 1.620283
H 0.878617 -2.912497 1.402896
H -0.817645 -2.953180 1.971933
H -1.373285 0.514949 -0.992895
H -1.609739 1.029959 0.681938
H -4.068650 0.089218 0.426315
H -3.799231 0.154094 -1.312245
H -1.510616 -4.111564 -0.174212
H 0.207866 -4.192067 -0.684063
H -0.335319 -5.057832 0.784530
H 2.454919 -0.073039 -2.924698
H 3.155981 3.365796 0.692968
H 3.796838 3.112207 2.363246
H 2.038975 2.855692 2.030885
H -5.230071 3.294320 -0.878380


