%chk=000186907.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186907

0 1
O 3.349271 1.225237 -0.197343
O 4.749155 -0.470128 0.575447
O -0.245992 -1.726837 -0.503379
O -1.176405 2.824893 0.517623
O -4.762834 -2.064272 -0.251826
O -1.766299 -3.297083 -0.716263
C 2.711727 -1.123272 -0.554640
C 1.540108 -0.219925 -0.324491
C 3.915777 -0.108773 -0.534490
C 0.171528 -0.479885 -0.275158
C -0.751300 0.590913 0.012386
C 1.995591 1.097136 -0.082737
C -2.125676 0.248635 0.039918
C -3.270069 1.182616 0.315425
C 3.030350 -1.996169 0.639128
C -2.565007 -1.044228 -0.196674
C -0.214227 1.896036 0.249582
C -4.528608 0.305515 0.222723
C 1.151545 2.175488 0.204640
C -4.042411 -1.113847 -0.106053
C 4.147961 -1.562000 1.237300
C -1.697421 -2.133459 -0.482704
C -0.762953 4.194830 0.783890
H 2.628044 -1.706219 -1.494703
H 4.560098 0.071187 -1.401179
H -3.282730 2.022525 -0.409419
H -3.160105 1.664880 1.308779
H 2.381364 -2.808967 0.914460
H -5.228911 0.654352 -0.556987
H -5.106987 0.297562 1.163728
H 1.570496 3.159094 0.381633
H 4.724558 -1.853678 2.093734
H -1.728279 4.685981 0.964666
H -0.127533 4.229898 1.674507
H -0.263125 4.613965 -0.094926


%chk=000186907-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186907

0 1
O 3.390751 1.258891 -0.166094
O 4.841902 -0.547550 0.559746
O -0.227423 -1.738297 -0.504713
O -1.184924 2.935728 0.523232
O -4.758655 -2.202623 -0.259623
O -1.871512 -3.354896 -0.692441
C 2.730614 -1.097401 -0.549650
C 1.548004 -0.172618 -0.328899
C 3.948235 -0.101091 -0.503878
C 0.174281 -0.428853 -0.274771
C -0.766809 0.625662 0.010705
C 2.000608 1.133721 -0.079773
C -2.157663 0.259029 0.039775
C -3.353597 1.160859 0.312713
C 3.027876 -2.017780 0.635157
C -2.570996 -1.058988 -0.195181
C -0.236639 1.948959 0.248942
C -4.589962 0.235657 0.215976
C 1.147644 2.217209 0.206554
C -4.051558 -1.175107 -0.105425
C 4.190117 -1.637512 1.214343
C -1.663598 -2.155991 -0.481347
C -0.705476 4.301106 0.781614
H 2.660368 -1.653658 -1.500026
H 4.551032 0.040811 -1.410906
H -3.377082 1.992106 -0.413742
H -3.248595 1.640886 1.301607
H 2.368373 -2.823251 0.952000
H -5.293154 0.541962 -0.578806
H -5.169390 0.193945 1.155342
H 1.564868 3.208517 0.386555
H 4.736109 -2.020127 2.074638
H -1.614369 4.889288 0.972222
H -0.046403 4.327173 1.669151
H -0.172277 4.706232 -0.098398


