%chk=000209911.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209911

0 1
O 2.464874 -0.761595 -0.608031
O 1.821688 -1.020227 1.560018
C 0.610253 -2.145660 -0.282995
C 0.620957 -3.539964 0.380634
C 1.829554 2.017704 -0.083219
C -0.745450 -1.482980 -0.186824
C 3.248400 1.489816 -0.091940
C 3.516817 0.125464 -0.289416
C 1.652608 -1.269956 0.395980
C -1.534199 -1.352002 -1.338890
C -1.231526 -1.014371 1.043527
C 1.362302 2.202207 1.365655
C 1.701489 3.318458 -0.884964
C -0.248759 -4.532117 -0.381829
C 4.358790 2.320109 0.117450
C 4.801202 -0.419060 -0.292830
C -3.284334 -0.293337 -0.031423
C 5.892335 0.440200 -0.092876
C -2.796361 -0.759715 -1.261801
C -2.492767 -0.424153 1.121303
C 5.659182 1.809413 0.114460
C -4.622193 0.332969 0.050615
C 7.280230 -0.111055 -0.090026
C -4.927743 1.449567 -0.743843
C -5.591362 -0.186787 0.923479
C -6.191639 2.039494 -0.662619
C -6.854393 0.405955 0.997190
C -7.156480 1.519125 0.206047
H 0.898268 -2.260896 -1.364870
H 0.272843 -3.455514 1.431221
H 1.662677 -3.916060 0.434889
H 1.166649 1.253665 -0.572049
H -1.166701 -1.711471 -2.299078
H -0.614599 -1.103743 1.941733
H 1.460292 1.262385 1.930825
H 0.312977 2.509093 1.410064
H 1.954074 2.957486 1.892371
H 2.230168 4.150512 -0.408400
H 0.651155 3.614877 -0.981122
H 2.108304 3.202140 -1.895824
H 4.202230 3.385858 0.288033
H -0.263016 -5.507972 0.118351
H -1.288809 -4.185744 -0.450881
H 0.111515 -4.692924 -1.404267
H 4.941158 -1.484955 -0.450330
H -3.407329 -0.663752 -2.158774
H -2.862947 -0.056492 2.078120
H 6.498180 2.482246 0.279002
H 7.472856 -0.725501 -0.980915
H 8.048817 0.672212 -0.066816
H 7.445786 -0.752286 0.788791
H -4.176021 1.858501 -1.417051
H -5.358702 -1.055421 1.537399
H -6.424978 2.907328 -1.277379
H -7.605107 -0.000742 1.672893
H -8.140415 1.979763 0.266532


%chk=000209911-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209911

0 1
O 2.452270 -0.839606 -0.701629
O 2.025195 -1.370978 1.543910
C 0.676410 -2.406380 -0.264135
C 0.616924 -3.762050 0.500348
C 1.654065 1.824086 0.389665
C -0.657579 -1.645932 -0.229723
C 3.103843 1.411688 0.123960
C 3.466447 0.130661 -0.359161
C 1.767111 -1.516147 0.332357
C -1.381593 -1.403819 -1.422326
C -1.202639 -1.180037 0.994956
C 1.410047 2.037628 1.908126
C 1.261924 3.086576 -0.422561
C -0.384876 -4.751958 -0.126349
C 4.176296 2.311487 0.351928
C 4.797354 -0.244115 -0.617312
C -3.169833 -0.254435 -0.172564
C 5.855073 0.668163 -0.386016
C -2.616845 -0.723714 -1.394973
C -2.434575 -0.497518 1.021141
C 5.519054 1.955237 0.104951
C -4.471360 0.473411 -0.143524
C 7.297043 0.267778 -0.645867
C -4.859634 1.319006 -1.219905
C -5.359595 0.344658 0.960397
C -6.090423 2.008569 -1.195368
C -6.590129 1.034981 0.987391
C -6.963152 1.870770 -0.090927
H 0.943178 -2.592329 -1.319896
H 0.356547 -3.564865 1.556528
H 1.630532 -4.208545 0.507148
H 0.991192 1.004891 0.055330
H -0.979352 -1.757904 -2.379023
H -0.645388 -1.331219 1.927051
H 1.670419 1.127792 2.476149
H 0.346960 2.278791 2.095392
H 2.022534 2.874451 2.293641
H 1.858348 3.966183 -0.115944
H 0.196183 3.329110 -0.256154
H 1.416823 2.930834 -1.505404
H 3.951209 3.316513 0.727606
H -0.402508 -5.699576 0.441643
H -1.409110 -4.338439 -0.130483
H -0.112424 -4.991151 -1.171872
H 4.998201 -1.251403 -0.998915
H -3.171425 -0.580546 -2.329156
H -2.815835 -0.117831 1.975846
H 6.316470 2.683881 0.293196
H 7.422348 -0.161410 -1.657042
H 7.976254 1.133066 -0.558448
H 7.636462 -0.497862 0.077681
H -4.179061 1.462065 -2.066995
H -5.098055 -0.323753 1.788675
H -6.364074 2.661169 -2.032132
H -7.261937 0.913489 1.844600
H -7.918514 2.406680 -0.070513


