%chk=000179777.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179777

0 1
O -2.372677 0.821641 -0.467466
O 1.894079 -1.284941 -0.289905
C -3.084373 -0.433726 -0.750515
C -4.482074 0.061589 -1.153454
C -3.219668 -1.273972 0.528768
C -5.484076 -0.731670 -0.300662
C -4.705449 -1.243131 0.926237
C -1.016734 0.811872 -0.310184
C 3.380079 -1.279368 -0.130668
C 1.171793 -0.141902 -0.204123
C 1.749563 1.125789 0.046828
C -0.211807 -0.324881 -0.384338
C 0.890165 2.250822 0.115697
C -0.482275 2.097289 -0.060754
C 3.946171 0.082168 0.138704
C 3.189562 1.186760 0.218534
C 3.860942 -1.848845 -1.463921
C 3.591675 -2.233776 1.042967
C 1.445682 3.613816 0.378143
H -2.546669 -0.953201 -1.565320
H -4.664390 -0.060824 -2.232085
H -4.557441 1.150241 -0.947841
H -2.581705 -0.862703 1.333298
H -2.873409 -2.307399 0.359029
H -5.899798 -1.576867 -0.876957
H -6.341363 -0.106754 -0.001402
H -4.857088 -0.566670 1.786671
H -5.059902 -2.236855 1.243338
H -0.596449 -1.319065 -0.569843
H -1.161813 2.942487 -0.012557
H 5.024708 0.105439 0.264487
H 3.633626 2.163106 0.415248
H 3.297848 -2.753033 -1.729196
H 3.708122 -1.128394 -2.277646
H 4.923913 -2.105305 -1.435437
H 3.253644 -1.781522 1.984043
H 3.012289 -3.156132 0.906475
H 4.644599 -2.506763 1.158550
H 2.163700 3.908314 -0.400970
H 0.667811 4.389262 0.405184
H 1.968788 3.651903 1.344644


%chk=000179777-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179777

0 1
O -2.414003 0.699296 -0.599827
O 1.917580 -1.410059 0.189110
C -3.086226 -0.618672 -0.791001
C -4.475502 -0.299726 -1.406312
C -3.375229 -1.290381 0.575876
C -5.533100 -0.599030 -0.297159
C -4.715012 -0.656354 1.020169
C -1.043080 0.725154 -0.309356
C 3.413311 -1.307660 -0.032962
C 1.153670 -0.241197 0.047311
C 1.729146 1.048582 0.238557
C -0.221124 -0.422338 -0.207470
C 0.879134 2.194765 0.137376
C -0.490124 2.022551 -0.141763
C 3.939241 0.001245 0.539302
C 3.144475 1.107978 0.611608
C 3.657143 -1.382862 -1.559518
C 3.979169 -2.535198 0.698297
C 1.438932 3.593969 0.334411
H -2.452968 -1.234608 -1.457721
H -4.654317 -0.895280 -2.318718
H -4.482821 0.764518 -1.698585
H -2.551391 -1.145622 1.295166
H -3.504009 -2.380753 0.421731
H -6.014718 -1.578680 -0.480557
H -6.332913 0.161311 -0.267731
H -4.531745 0.365765 1.400852
H -5.220008 -1.231261 1.816339
H -0.600619 -1.440320 -0.318100
H -1.157236 2.884800 -0.234644
H 4.988603 0.022904 0.855587
H 3.552476 2.054127 0.984086
H 3.251130 -2.326726 -1.965862
H 3.169506 -0.534408 -2.070481
H 4.740052 -1.338589 -1.777439
H 3.768141 -2.471848 1.778963
H 3.520101 -3.458162 0.304301
H 5.072876 -2.595663 0.551911
H 2.258729 3.809692 -0.376046
H 0.654595 4.354744 0.187456
H 1.847733 3.728797 1.354443


