%chk=000289410.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289410

0 1
O 4.032093 -0.786734 -0.262010
O 9.834925 1.400456 0.856661
O 10.427413 -0.547587 -0.060199
C -4.598698 0.386298 0.175704
C -5.889854 -0.355776 -0.195161
C -3.355192 -0.432511 -0.196400
C -7.133656 0.462644 0.176888
C -2.064003 0.309602 0.174282
C -8.424778 -0.279507 -0.193940
C -0.821486 -0.510378 -0.198124
C -9.668834 0.538640 0.177928
C 0.469805 0.231796 0.172401
C -10.959610 -0.203685 -0.192820
C 1.706316 -0.592126 -0.201819
C -12.205057 0.613600 0.178517
C 2.987505 0.149827 0.168313
C -13.492830 -0.120732 -0.188224
C 5.338091 -0.441130 -0.079811
C 6.237874 -1.433612 -0.538597
C 5.790174 0.758085 0.495875
C 7.597861 -1.209151 -0.413238
C 7.163953 0.963829 0.612525
C 8.071660 -0.008502 0.163361
C 9.520659 0.183423 0.274436
H -4.569910 1.368335 -0.334670
H -4.592083 0.609974 1.259969
H -5.897565 -0.579497 -1.279421
H -5.919662 -1.337903 0.314998
H -3.385429 -1.414643 0.313929
H -3.363374 -0.656490 -1.280697
H -7.126794 0.686335 1.261111
H -7.104743 1.444688 -0.333390
H -2.035704 1.291512 -0.336561
H -2.057910 0.533374 1.258625
H -8.454420 -1.261586 0.316248
H -8.432347 -0.503314 -1.278149
H -0.852245 -1.492774 0.312343
H -0.830152 -0.734933 -1.282617
H -9.661739 0.762398 1.262117
H -9.639759 1.520590 -0.332480
H 0.497106 1.213345 -0.340423
H 0.474897 0.454196 1.257610
H -10.990475 -1.185811 0.316830
H -10.968458 -0.428233 -1.276686
H 1.688175 -1.579574 0.303930
H 1.710191 -0.823993 -1.286895
H -12.176723 1.595785 -0.332637
H -12.198671 0.837235 1.263282
H 3.092699 0.314513 1.253405
H 3.115432 1.093641 -0.387069
H -13.549089 -0.324466 -1.263566
H -13.571080 -1.082455 0.331389
H -14.375749 0.469915 0.080302
H 5.843840 -2.347967 -0.978160
H 5.099163 1.516721 0.846599
H 8.320712 -1.956306 -0.757987
H 7.545513 1.889118 1.057143
H 10.816919 1.532000 0.932633


%chk=000289410-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289410

0 1
O 4.183745 -0.910372 -0.402603
O 9.891494 1.565849 1.219877
O 10.613351 -0.405828 0.227134
C -4.622800 0.390876 0.045382
C -5.951725 -0.343054 -0.243664
C -3.372671 -0.442796 -0.315411
C -7.203231 0.489998 0.113918
C -2.042850 0.278375 0.000545
C -8.531150 -0.252276 -0.157994
C -0.795380 -0.556442 -0.365784
C -9.783755 0.580069 0.197930
C 0.534742 0.146652 -0.012209
C -11.110993 -0.167159 -0.063698
C 1.772864 -0.698356 -0.391593
C -12.364159 0.665254 0.291888
C 3.080201 -0.014154 0.009640
C -13.684920 -0.091716 0.032934
C 5.493432 -0.520272 -0.125955
C 6.500332 -1.431521 -0.546248
C 5.851466 0.689949 0.527140
C 7.849559 -1.135095 -0.314212
C 7.210928 0.977266 0.755373
C 8.221266 0.073518 0.340271
C 9.658468 0.339919 0.563105
H -4.601847 1.347040 -0.518387
H -4.583135 0.663825 1.120926
H -5.991133 -0.620671 -1.317964
H -5.972850 -1.296968 0.324009
H -3.404613 -1.406550 0.234728
H -3.403096 -0.700583 -1.394844
H -7.158056 0.777236 1.185534
H -7.189201 1.438920 -0.462276
H -2.011584 1.245478 -0.543621
H -2.012182 0.528837 1.081811
H -8.545114 -1.199891 0.420396
H -8.576235 -0.542197 -1.228843
H -0.841308 -1.533391 0.158816
H -0.812127 -0.785334 -1.451616
H -9.735339 0.875679 1.267165
H -9.774147 1.524678 -0.385530
H 0.578223 1.127946 -0.529223
H 0.550545 0.364903 1.076298
H -11.122160 -1.111062 0.520892
H -11.161123 -0.464105 -1.132450
H 1.721356 -1.687001 0.103503
H 1.784732 -0.884915 -1.482401
H -12.354629 1.606471 -0.295161
H -12.311310 0.964610 1.358783
H 3.126069 0.144349 1.106995
H 3.194331 0.965488 -0.498952
H -13.776163 -0.375897 -1.032574
H -13.732532 -1.020822 0.631940
H -14.564756 0.524628 0.294771
H 6.193875 -2.354534 -1.046872
H 5.088722 1.401424 0.855245
H 8.638809 -1.824718 -0.630467
H 7.501348 1.904420 1.257331
H 10.873312 1.674521 1.333875


