%chk=000190129.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190129

0 1
O -2.802873 0.694012 0.356902
O -4.646999 1.889151 -0.156171
C -1.937622 1.857061 0.052168
C 0.470984 0.960827 -0.079169
C 0.276495 0.627442 -1.431477
C -0.639597 1.497494 0.780943
C -1.812966 2.000821 -1.462212
C -1.070102 0.809659 -2.072180
C 2.597876 -0.083835 -1.594049
C 2.807456 0.269285 -0.240622
C 1.342574 0.104423 -2.176964
C 3.737697 -0.642955 -2.400105
C 1.734570 0.778455 0.501961
C 4.663258 -1.508488 -1.533530
C 4.144533 0.080607 0.355355
C 5.064501 -0.791036 -0.274165
C 4.533925 0.752024 1.524093
C 6.331814 -0.993043 0.283515
C 5.803206 0.548760 2.072801
C 6.700350 -0.326403 1.456125
C -4.159655 0.837630 0.201990
C -4.863584 -0.424159 0.535893
C -6.267938 -0.423215 0.523410
C -4.158122 -1.594155 0.853670
C -6.962419 -1.594830 0.831025
C -4.859959 -2.762570 1.159843
C -6.259141 -2.762467 1.148792
H -2.433092 2.746735 0.502394
H -0.880985 0.734276 1.561220
H -0.281210 2.389524 1.336795
H -1.279303 2.944313 -1.696254
H -2.822222 2.101105 -1.912921
H -0.980898 0.940606 -3.167966
H -1.667039 -0.117717 -1.919493
H 1.187204 -0.159859 -3.221416
H 3.368485 -1.236067 -3.259157
H 4.312413 0.202299 -2.838319
H 1.881838 1.031416 1.552034
H 5.550539 -1.811227 -2.122772
H 4.145625 -2.452811 -1.255830
H 3.845055 1.442921 2.009139
H 7.037098 -1.668854 -0.195919
H 6.091221 1.074943 2.980505
H 7.687694 -0.487788 1.884360
H -6.804437 0.495818 0.271909
H -3.064701 -1.581179 0.858828
H -8.051436 -1.598787 0.823115
H -4.316447 -3.673256 1.407144
H -6.804061 -3.675703 1.388462


%chk=000190129-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190129

0 1
O -2.667599 0.821395 0.271976
O -4.762085 1.828885 0.044912
C -2.009606 2.141928 -0.029528
C 0.425224 1.313141 -0.173672
C 0.201911 0.918084 -1.521083
C -0.622549 2.090523 0.620356
C -1.928558 2.331056 -1.554394
C -1.129258 1.186905 -2.212752
C 2.464185 -0.084898 -1.594131
C 2.693812 0.311856 -0.239905
C 1.231372 0.222202 -2.202264
C 3.570072 -0.812105 -2.345133
C 1.658158 0.997132 0.441783
C 4.326249 -1.772022 -1.398843
C 4.001035 -0.003685 0.399318
C 4.822153 -1.030153 -0.164875
C 4.465385 0.681903 1.554157
C 6.060141 -1.347128 0.438097
C 5.699736 0.353977 2.152178
C 6.503349 -0.667799 1.595632
C -4.065074 0.805637 0.269473
C -4.610105 -0.551032 0.571616
C -6.019941 -0.705314 0.626061
C -3.765244 -1.668743 0.799220
C -6.580957 -1.967485 0.907958
C -4.331870 -2.930052 1.080258
C -5.738069 -3.082003 1.135651
H -2.638612 2.927214 0.427001
H -0.719542 1.672752 1.639923
H -0.278497 3.137914 0.746036
H -1.430071 3.302715 -1.743230
H -2.946375 2.394473 -1.977169
H -0.960583 1.412531 -3.282635
H -1.741687 0.263030 -2.181564
H 1.061888 -0.088891 -3.242004
H 3.150897 -1.364973 -3.205885
H 4.289313 -0.072449 -2.755800
H 1.799690 1.279206 1.492598
H 5.172724 -2.250732 -1.924598
H 3.636880 -2.585380 -1.088399
H 3.868924 1.496556 1.979120
H 6.682596 -2.134860 -0.004213
H 6.038857 0.899265 3.040003
H 7.466526 -0.924220 2.050706
H -6.650159 0.171970 0.446128
H -2.680652 -1.536174 0.753978
H -7.669150 -2.084890 0.950684
H -3.680595 -3.793036 1.256259
H -6.174637 -4.063022 1.354695


