%chk=000297640.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297640

0 1
O 1.021777 0.729441 1.169423
O 1.008796 0.756663 -1.164466
C 3.082155 0.130691 -0.016338
C 4.638324 0.145848 -0.024776
C 3.111487 -1.424856 -0.034821
C 4.655780 -1.400058 -0.043405
C 2.463026 0.743363 1.244351
C 2.449111 0.772829 -1.255254
C 0.499550 1.405750 0.013061
C -0.997571 1.204807 0.018772
C -1.582637 -0.105450 0.007922
C -1.799995 2.325884 0.034773
C -2.999041 -0.221250 0.014284
C -0.792783 -1.300923 -0.009205
C -3.216634 2.201040 0.040982
C -3.803888 0.960216 0.031077
C -3.596194 -1.523324 0.003655
C -1.390234 -2.534645 -0.019165
C -2.812030 -2.648278 -0.012617
H 5.098557 0.595474 0.861088
H 5.088763 0.616620 -0.904748
H 2.649802 -1.876991 -0.919855
H 2.659986 -1.897802 0.844502
H 5.114018 -1.838911 -0.936238
H 5.124169 -1.860102 0.833455
H 2.649929 0.140165 2.152016
H 2.804646 1.779459 1.411595
H 2.788863 1.812697 -1.401597
H 2.625849 0.191313 -2.178942
H 0.828977 2.465217 0.023738
H -1.370175 3.326828 0.042997
H 0.297518 -1.190310 -0.013968
H -3.820995 3.106522 0.053700
H -4.887957 0.855078 0.035804
H -4.681875 -1.597840 0.008770
H -0.793176 -3.444129 -0.032185
H -3.257596 -3.641336 -0.020788


%chk=000297640-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297640

0 1
O 1.065985 0.612247 1.211716
O 1.051503 0.635145 -1.209958
C 3.183352 0.182329 -0.015822
C 4.757132 0.224201 -0.025075
C 3.230505 -1.389578 -0.030852
C 4.799875 -1.346534 -0.041992
C 2.534006 0.797957 1.235154
C 2.519176 0.821211 -1.247280
C 0.498760 1.243303 0.010049
C -1.004934 1.099670 0.017753
C -1.657595 -0.189057 0.006615
C -1.771036 2.270274 0.036260
C -3.108742 -0.229513 0.015165
C -0.940465 -1.432662 -0.012880
C -3.198002 2.225970 0.044832
C -3.853778 0.995510 0.034412
C -3.778197 -1.498511 0.004063
C -1.621509 -2.651476 -0.023376
C -3.051625 -2.689460 -0.014880
H 5.204733 0.689164 0.871760
H 5.193930 0.708564 -0.916976
H 2.770680 -1.843573 -0.925150
H 2.784070 -1.859916 0.861780
H 5.264809 -1.778736 -0.943552
H 5.278396 -1.797984 0.842874
H 2.875595 0.308296 2.162074
H 2.769330 1.886700 1.289910
H 2.754186 1.910786 -1.284438
H 2.849662 0.348977 -2.187168
H 0.796540 2.320785 0.018454
H -1.266478 3.244131 0.044590
H 0.150534 -1.406011 -0.019510
H -3.769050 3.160278 0.059537
H -4.949497 0.948292 0.040670
H -4.874895 -1.515237 0.010643
H -1.058094 -3.591336 -0.038360
H -3.570560 -3.654503 -0.023444


