%chk=000183237.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183237

0 1
O -4.527825 -1.440582 -1.093543
O -4.762534 1.031644 1.473821
C 1.712692 -1.306551 0.034367
C 2.523503 -0.158378 -0.000107
C 2.596885 -2.529239 0.063440
C 0.327341 -1.154463 0.044915
C -0.232185 0.178420 -0.041037
C 4.061241 -1.983106 0.005846
C 3.932576 -0.481002 -0.008434
C 2.022270 1.155370 0.023117
C 0.610423 1.312822 0.047682
C -1.684057 0.252432 -0.192102
C -2.471980 -0.851870 0.047219
C -3.982253 -0.777316 0.052994
C -0.540242 -2.300071 0.189819
C -4.554620 0.667938 0.104153
C -1.888635 -2.150340 0.247051
C 4.845353 0.527672 -0.011815
C 3.026312 2.195026 0.024465
C -2.346365 1.462987 -0.701674
C 0.074710 2.695951 0.239332
C -3.664866 1.666482 -0.580555
C 4.359573 1.886027 0.001288
H 2.387976 -3.194970 -0.792164
H 2.432381 -3.121750 0.980609
H 4.648141 -2.327238 0.875180
H 4.584699 -2.347791 -0.895486
H -4.412633 -1.364467 0.904364
H -0.075837 -3.282205 0.272407
H -5.593202 0.669653 -0.309790
H -2.556372 -2.999603 0.396765
H 5.916123 0.352739 -0.019781
H 2.693934 3.231777 0.038922
H -1.716382 2.172072 -1.248187
H -0.761822 2.711692 0.954007
H -0.278414 3.130612 -0.708779
H 0.831966 3.384925 0.642230
H -4.159757 2.556846 -0.961749
H 5.106774 2.680001 -0.004771
H -4.079461 -1.138332 -1.912428
H -3.904033 1.187186 1.923713


%chk=000183237-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183237

0 1
O -4.441879 -1.385348 -1.364632
O -4.809378 0.910676 1.573435
C 1.731253 -1.312283 0.079586
C 2.546598 -0.173358 -0.020094
C 2.604483 -2.561360 0.162306
C 0.326127 -1.156449 0.104369
C -0.251320 0.199243 -0.001810
C 4.077707 -2.025553 -0.009604
C 3.940311 -0.504205 -0.045787
C 2.034269 1.166764 -0.012121
C 0.612130 1.353934 0.041213
C -1.712179 0.273432 -0.131741
C -2.506745 -0.876080 0.085528
C -4.021008 -0.812988 -0.055914
C -0.532028 -2.298035 0.271191
C -4.620194 0.600553 0.128624
C -1.910814 -2.155673 0.316301
C 4.876436 0.522669 -0.084932
C 3.036797 2.206461 -0.048114
C -2.411890 1.479797 -0.630847
C 0.111436 2.776749 0.263055
C -3.768485 1.646852 -0.550390
C 4.397899 1.884326 -0.091300
H 2.346673 -3.301601 -0.618381
H 2.480931 -3.073977 1.136233
H 4.732819 -2.359338 0.815640
H 4.527955 -2.404723 -0.946510
H -4.504287 -1.477836 0.680064
H -0.072772 -3.287046 0.374320
H -5.648113 0.584042 -0.268063
H -2.564163 -3.023085 0.459258
H 5.953825 0.324886 -0.105561
H 2.740908 3.260084 -0.062025
H -1.815140 2.245030 -1.131852
H -0.876877 2.799821 0.746107
H 0.045522 3.366338 -0.673203
H 0.809182 3.314595 0.928796
H -4.248435 2.545908 -0.950637
H 5.133949 2.696169 -0.129058
H -3.922341 -0.933447 -2.079685
H -3.927761 1.165059 1.951540


