%chk=000191620.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191620

0 1
O -3.629140 -0.136889 -1.726326
O 3.033282 -1.301371 -1.951709
C -1.378988 1.018968 -0.179238
C -2.039150 -0.352453 0.165212
C 0.070378 1.070841 0.318254
C 0.861493 -0.047788 -0.417252
C 2.343687 -0.064279 0.051013
C -1.295992 -1.441613 -0.621463
C 0.199734 -1.434932 -0.262957
C -3.522754 -0.069975 -0.286447
C -2.388159 2.060307 0.335388
C 0.715424 2.437460 0.032960
C -3.765928 1.434324 0.026967
C 2.957256 1.313761 -0.156408
C 2.536407 -0.510675 1.523140
C -2.039315 -0.675310 1.665602
C 2.186524 2.451671 0.464827
C 3.117482 -1.131594 -0.761543
C 3.794951 -1.398210 1.569864
C 3.984252 -1.967922 0.159956
C -4.515299 -0.960244 0.295431
C 4.101307 1.523507 -0.809900
C -5.348822 -1.695581 0.759521
H -1.362020 1.110740 -1.299799
H 0.097622 0.882865 1.417172
H 0.875585 0.198597 -1.512525
H -1.419200 -1.270406 -1.710013
H -1.725458 -2.438221 -0.414440
H 0.333559 -1.800877 0.775408
H 0.724451 -2.162299 -0.914444
H -2.265378 3.031143 -0.170008
H -2.265322 2.247946 1.414410
H 0.162013 3.236281 0.560393
H 0.640895 2.677610 -1.046114
H -4.470609 1.563182 0.862057
H -4.230368 1.908171 -0.860193
H 1.650701 -1.078439 1.868290
H 2.629958 0.352024 2.202627
H -2.630943 0.047268 2.238699
H -2.458093 -1.669200 1.858723
H -1.023694 -0.660164 2.077281
H 2.261409 2.382878 1.570024
H 2.641051 3.427024 0.198354
H 3.692855 -2.197960 2.321624
H 4.676584 -0.801446 1.867570
H 3.685436 -3.030868 0.095657
H 5.039207 -1.940340 -0.168266
H -3.633108 -1.063463 -2.037780
H 4.694653 0.751938 -1.275606
H 4.532008 2.503420 -0.950961
H -6.064924 -2.325008 1.158070


%chk=000191620-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191620

0 1
O -3.535236 0.094016 -1.846813
O 2.958902 -1.480437 -1.928266
C -1.393865 1.019174 -0.081174
C -2.106923 -0.338923 0.198987
C 0.074359 1.050996 0.389146
C 0.843896 -0.113534 -0.313093
C 2.365422 -0.133166 0.085985
C -1.349637 -1.459922 -0.547990
C 0.144061 -1.488784 -0.121620
C -3.550241 0.003988 -0.355628
C -2.387368 2.079875 0.452518
C 0.739224 2.411316 0.072416
C -3.793699 1.476766 0.126632
C 2.974628 1.257482 -0.218556
C 2.674862 -0.526950 1.571205
C -2.224106 -0.671705 1.709744
C 2.243925 2.416997 0.444410
C 3.125529 -1.230528 -0.710032
C 4.093468 -1.161300 1.530204
C 4.094684 -1.976136 0.216496
C -4.597093 -0.951552 0.042054
C 4.046190 1.463987 -1.028353
C -5.470516 -1.775102 0.321907
H -1.380727 1.127592 -1.187920
H 0.115498 0.899051 1.490281
H 0.829620 0.100542 -1.404994
H -1.396438 -1.270333 -1.639130
H -1.810832 -2.449580 -0.356611
H 0.212685 -1.818417 0.933266
H 0.670933 -2.249322 -0.727958
H -2.248177 3.064713 -0.025577
H -2.260907 2.220480 1.543466
H 0.220192 3.223256 0.617148
H 0.631118 2.623212 -1.011097
H -4.469763 1.497515 0.997681
H -4.293029 2.010902 -0.699056
H 1.943311 -1.279160 1.922578
H 2.622944 0.328950 2.264196
H -2.805003 0.089066 2.259975
H -2.735786 -1.641185 1.845480
H -1.233810 -0.743368 2.189333
H 2.332784 2.351163 1.548839
H 2.711869 3.372288 0.143110
H 4.299460 -1.782482 2.418723
H 4.861146 -0.367736 1.484896
H 3.685138 -2.995049 0.376537
H 5.081738 -2.100237 -0.261882
H -3.526564 -0.827014 -2.215612
H 4.555862 0.654707 -1.561759
H 4.425380 2.477580 -1.206506
H -6.241609 -2.479299 0.573516


