%chk=000196730.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196730

0 1
O -0.802078 2.303697 0.113902
O 1.685301 2.456883 0.126519
O 2.151841 -2.912407 -0.148656
O -5.166553 -2.345437 -0.035489
O 4.143945 2.703969 0.130351
O 6.916229 -1.139439 -0.067506
O -5.916670 1.734741 0.449560
O -6.707374 -0.310261 0.120625
C -1.891490 0.205308 -0.007714
C 0.606163 0.383218 0.012616
C 0.690826 -1.039760 -0.052626
C -1.747016 -1.220769 -0.049374
C -0.669745 0.979463 0.036902
C -0.431333 -1.814746 -0.080205
C -3.196629 0.787377 -0.000485
C 3.121049 0.583691 0.025087
C 3.259318 -0.817838 -0.045740
C 1.798641 1.221248 0.059285
C 2.036848 -1.707259 -0.088182
C -2.880587 -2.041469 -0.066513
C -4.334541 -0.042769 0.051834
C -4.151331 -1.470221 -0.015444
C 4.307293 1.361455 0.062658
C -3.324342 2.261404 -0.067442
C 4.504436 -1.428080 -0.078398
C 5.660262 -0.614030 -0.039080
C 5.586072 0.777506 0.031256
C -5.709124 0.408053 0.187991
H -0.355018 -2.906104 -0.125387
H -2.789996 -3.127302 -0.117253
H 4.577096 -2.515444 -0.133222
H -2.665109 2.698535 -0.842770
H -4.336477 2.638950 -0.279983
H -3.001310 2.731963 0.880676
H 6.495511 1.371184 0.059931
H 0.161754 2.818304 0.151204
H -6.112523 -1.913899 -0.016439
H 5.012884 3.195345 0.154167
H 6.914730 -2.133782 -0.117528
H -6.895252 1.937422 0.548370


%chk=000196730-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196730

0 1
O -0.739444 2.395177 0.168817
O 1.667449 2.562608 0.185040
O 2.164352 -2.939350 -0.168584
O -5.215032 -2.396236 -0.015888
O 4.310620 2.774644 0.171312
O 6.966286 -1.226578 -0.090356
O -6.018347 1.689965 0.577736
O -6.760500 -0.425107 0.135676
C -1.903914 0.252215 -0.011377
C 0.615670 0.421317 0.019815
C 0.712149 -1.011951 -0.056808
C -1.743937 -1.195245 -0.045696
C -0.681136 1.045994 0.050508
C -0.438764 -1.790653 -0.079546
C -3.228579 0.824162 -0.024420
C 3.142253 0.636748 0.042435
C 3.257654 -0.790750 -0.048960
C 1.808914 1.259707 0.086413
C 2.044362 -1.673447 -0.096656
C -2.880135 -2.036493 -0.067034
C -4.361275 -0.053852 0.047496
C -4.171587 -1.502227 -0.010310
C 4.366001 1.388841 0.085094
C -3.416490 2.320633 -0.191548
C 4.508080 -1.436752 -0.094591
C 5.688895 -0.666299 -0.050249
C 5.619528 0.737901 0.039155
C -5.761725 0.375112 0.223175
H -0.337179 -2.879688 -0.122984
H -2.769622 -3.122918 -0.117802
H 4.517260 -2.530904 -0.162424
H -2.662707 2.723089 -0.883178
H -4.423440 2.568505 -0.544916
H -3.252517 2.852188 0.763652
H 6.554856 1.308196 0.071744
H 0.316517 2.738471 0.202238
H -6.094864 -1.868634 -0.000038
H 5.225595 3.158071 0.190339
H 6.923519 -2.213481 -0.151522
H -7.003064 1.785719 0.701738


