%chk=000185441.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185441

0 1
O 1.832209 -0.277777 0.179421
O -3.591424 0.776350 0.283807
O -2.113781 2.633635 0.320688
O 0.154316 -2.371386 -0.073386
O -2.481383 -2.110243 0.183600
C 4.133906 0.080901 0.096934
C 0.502892 0.034096 0.180936
C 2.801808 0.823401 0.156961
C -2.254381 0.348256 0.241765
C -1.381851 1.460856 0.266188
C -0.345089 -1.100695 0.136159
C 5.307659 1.063453 0.013582
C -1.762516 -0.955737 0.190212
C -0.004813 1.352711 0.246631
C -3.528149 2.234398 0.327118
C 6.644579 0.329166 -0.042565
C 0.865675 -2.916432 1.073752
C -3.930252 -1.954167 0.165140
H 4.135873 -0.606639 -0.774746
H 4.237233 -0.578048 0.982240
H 2.677241 1.416719 1.077499
H 2.612412 1.440279 -0.737274
H 5.293839 1.746571 0.886054
H 5.199338 1.708134 -0.881555
H 0.628855 2.228810 0.274405
H -3.961342 2.567205 1.279136
H -3.985990 2.625162 -0.590913
H 6.805245 -0.290322 0.847545
H 6.707367 -0.331653 -0.915460
H 7.481320 1.034522 -0.105922
H 1.747689 -2.302992 1.285132
H 1.146237 -3.910101 0.709235
H 0.197993 -2.980869 1.934941
H -4.261875 -1.423644 1.063896
H -4.266148 -2.996839 0.155706
H -4.236791 -1.418680 -0.739460


%chk=000185441-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185441

0 1
O 1.864425 -0.392175 0.242103
O -3.601793 0.875445 0.571780
O -2.047562 2.685674 0.580566
O 0.073537 -2.463624 0.052844
O -2.609298 -2.096568 0.372250
C 4.229108 0.079576 0.042064
C 0.504010 -0.051212 0.302706
C 2.841248 0.710810 0.168631
C -2.263258 0.383064 0.394111
C -1.352181 1.452129 0.418775
C -0.398063 -1.156766 0.261246
C 5.341590 1.148169 -0.074003
C -1.815497 -0.952292 0.330148
C 0.032352 1.288498 0.386022
C -3.465573 2.333217 0.334253
C 6.747365 0.521836 -0.195127
C 0.706396 -3.094042 1.229633
C -4.013013 -1.978005 -0.068440
H 4.242979 -0.579923 -0.846461
H 4.416385 -0.563458 0.923586
H 2.771944 1.333813 1.085620
H 2.611686 1.347614 -0.711548
H 5.309806 1.815127 0.811885
H 5.146076 1.790279 -0.956924
H 0.697660 2.151791 0.422362
H -4.101325 2.872093 1.051108
H -3.712588 2.554207 -0.724214
H 6.978840 -0.105151 0.686246
H 6.818540 -0.121176 -1.092151
H 7.529226 1.299092 -0.272533
H 1.594942 -2.518860 1.547581
H 1.006762 -4.098815 0.894937
H -0.019179 -3.176179 2.061431
H -4.592075 -1.322308 0.603264
H -4.401092 -3.006807 -0.034993
H -4.064478 -1.586671 -1.101355


