%chk=000221943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221943

0 1
O -1.026950 0.264342 0.973897
O -0.518814 -0.673899 -1.105193
C 1.057298 0.958179 -0.133904
C -1.592176 -0.303907 -0.214744
C -0.122943 1.368714 0.782282
C 0.437251 0.353157 -1.420082
C -2.569106 0.644143 -0.926017
C -2.184408 -1.651641 0.219251
C 1.902055 -0.109393 0.594399
C 1.872962 2.211392 -0.524477
C -3.880620 0.771512 -0.144302
C -3.517976 -1.473875 0.949913
C -4.493677 -0.605435 0.145013
C 3.138704 -0.574593 -0.182075
C 2.503579 2.935022 0.661554
C 3.868845 -1.702649 0.561328
C 5.112185 -2.165584 -0.195011
H 0.195841 1.583095 1.817716
H -0.683145 2.229352 0.381148
H -0.052106 1.114012 -2.049294
H 1.180966 -0.205708 -2.019460
H -2.761621 0.245772 -1.941992
H -2.114087 1.640146 -1.068188
H -1.451857 -2.169724 0.870850
H -2.301303 -2.288357 -0.679968
H 1.234745 -0.977844 0.796616
H 2.206458 0.272574 1.586875
H 1.226343 2.918375 -1.081262
H 2.670530 1.914937 -1.236020
H -4.595617 1.396381 -0.710196
H -3.687897 1.300846 0.810995
H -3.330770 -1.006222 1.938546
H -3.965784 -2.463991 1.153941
H -5.441206 -0.487217 0.702521
H -4.755810 -1.110524 -0.803984
H 2.841762 -0.926218 -1.190351
H 3.830022 0.274011 -0.345134
H 1.750255 3.333245 1.349650
H 3.157099 2.269124 1.239403
H 3.116025 3.779635 0.324558
H 3.181505 -2.559004 0.710230
H 4.152782 -1.363789 1.576544
H 5.831204 -1.349865 -0.328938
H 4.858972 -2.546938 -1.190821
H 5.625082 -2.970686 0.342878


%chk=000221943-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221943

0 1
O -1.085035 0.200824 0.953841
O -0.500608 -0.715951 -1.211865
C 1.041936 0.960174 -0.148243
C -1.611702 -0.368360 -0.305425
C -0.164941 1.337674 0.756373
C 0.427472 0.402758 -1.463213
C -2.623387 0.590514 -0.982748
C -2.265151 -1.701913 0.079566
C 1.901819 -0.121557 0.570833
C 1.849599 2.243963 -0.506287
C -3.878126 0.799142 -0.100234
C -3.527278 -1.495973 0.948759
C -4.540871 -0.551622 0.259139
C 3.162886 -0.610342 -0.177494
C 2.567407 2.933586 0.676440
C 3.943611 -1.671771 0.632132
C 5.199027 -2.187934 -0.103440
H 0.157143 1.598970 1.778292
H -0.705425 2.207795 0.322087
H -0.088097 1.220498 -2.012824
H 1.199150 -0.022374 -2.125839
H -2.910663 0.131085 -1.948700
H -2.156461 1.565283 -1.215596
H -1.510877 -2.309978 0.609293
H -2.523328 -2.228431 -0.858881
H 1.245995 -0.989161 0.774427
H 2.207190 0.273317 1.562223
H 1.159772 2.973364 -0.980957
H 2.599536 1.987790 -1.281664
H -4.596749 1.456841 -0.626418
H -3.580048 1.315699 0.833348
H -3.224783 -1.061842 1.920805
H -3.994673 -2.477150 1.158304
H -5.414158 -0.382896 0.918585
H -4.923150 -1.030879 -0.666414
H 2.881634 -1.051314 -1.155200
H 3.840903 0.240021 -0.397735
H 1.858097 3.240393 1.466531
H 3.319735 2.269240 1.137564
H 3.092163 3.843039 0.331008
H 3.268541 -2.521876 0.858157
H 4.237064 -1.240277 1.611276
H 5.902885 -1.361133 -0.317810
H 4.927419 -2.654506 -1.069364
H 5.739125 -2.943827 0.496063


