%chk=000183951.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183951

0 1
O -2.936681 1.991111 -0.119090
O -0.622875 0.459572 -1.432488
O 0.719077 2.066757 -0.382499
O -2.236015 -1.281491 1.349469
O -3.676342 -2.692180 0.317563
C -2.343890 1.007693 0.787849
C -1.516114 2.118091 0.195674
C -2.193512 -0.385212 0.199853
C -0.567319 1.795534 -0.954118
C -0.810107 -0.573836 -0.445707
C 1.866383 1.667984 -1.171043
C -3.025330 -2.408238 1.288135
C 2.454525 0.405255 -0.597638
C 2.507324 0.230148 0.793088
C 2.966323 -0.585146 -1.446837
C 3.070832 -0.929444 1.330066
C 3.534334 -1.741720 -0.903856
C 3.587381 -1.915703 0.482598
H -2.711214 1.053897 1.817612
H -1.249965 3.007041 0.777543
H -3.027157 -0.623121 -0.505848
H -0.731091 2.389806 -1.878704
H 0.008145 -0.540437 0.297828
H -0.742642 -1.496505 -1.049891
H 2.555130 2.527679 -1.038546
H 1.589703 1.565951 -2.234766
H -2.908997 -2.915968 2.248084
H 2.097974 1.003701 1.444391
H 2.920743 -0.461009 -2.527221
H 3.111223 -1.063800 2.409682
H 3.934879 -2.509235 -1.564197
H 4.030674 -2.816675 0.902014


%chk=000183951-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183951

0 1
O -3.067862 2.059201 -0.701745
O -0.677247 0.404248 -1.448954
O 0.618600 1.876763 -0.012261
O -2.796463 -1.139967 1.249656
O -3.246237 -3.043435 -0.047131
C -2.701374 1.119810 0.423263
C -1.720683 2.158357 -0.026404
C -2.506520 -0.335733 0.016036
C -0.533103 1.748062 -0.887821
C -1.058136 -0.605276 -0.440065
C 1.943744 1.731309 -0.696512
C -3.160244 -2.467879 1.053486
C 2.637396 0.438247 -0.317434
C 3.511244 0.403794 0.798804
C 2.431905 -0.748749 -1.066477
C 4.163652 -0.794557 1.166399
C 3.086479 -1.946641 -0.704903
C 3.953699 -1.972986 0.413299
H -3.266306 1.274412 1.350155
H -1.566599 3.064173 0.569663
H -3.224869 -0.622739 -0.772590
H -0.435785 2.386421 -1.788135
H -0.370379 -0.562913 0.426011
H -0.971030 -1.575688 -0.949909
H 2.529385 2.603430 -0.355842
H 1.790967 1.795160 -1.791009
H -3.361604 -2.919642 2.042630
H 3.678409 1.317985 1.381893
H 1.750369 -0.727427 -1.925246
H 4.836420 -0.808793 2.031195
H 2.924608 -2.856302 -1.293973
H 4.462961 -2.902143 0.692920


