%chk=000116260.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116260

2 1
O -5.864008 -1.419498 -0.850715
O 5.865155 -1.413922 0.852279
N -3.714415 0.066171 0.404889
N 3.714399 0.068693 -0.404938
C -3.523661 -0.768541 -0.862514
C -5.192305 0.465256 0.528290
C 3.524297 -0.764801 0.863367
C 5.191975 0.468810 -0.528769
C -2.887384 1.357596 0.310631
C 2.886347 1.359564 -0.312073
C -3.292758 -0.721689 1.623237
C 3.293373 -0.720811 -1.622436
C -4.530639 -1.931780 -0.933652
C -6.124712 -0.750549 0.388618
C 4.532190 -1.927168 0.935761
C 6.125340 -0.746107 -0.387774
C -1.400895 1.162907 0.150610
C 1.400015 1.163864 -0.151830
C -0.825197 1.139122 -1.129480
C 0.564348 1.139946 -1.279472
C -0.565209 1.141107 1.278283
C 0.824337 1.141234 1.128290
H -2.480287 -1.148783 -0.917758
H -3.681421 -0.110910 -1.753279
H -5.441456 1.197076 -0.281021
H -5.374144 0.985014 1.496920
H 2.481221 -1.145799 0.919022
H 3.681534 -0.106087 1.753423
H 5.440547 1.201706 0.279745
H 5.373404 0.987659 -1.497963
H -3.089757 1.978915 1.222267
H -3.279298 1.973293 -0.541605
H 3.088208 1.980052 -1.224386
H 3.277791 1.976498 0.539487
H -3.899799 -1.641944 1.746572
H -2.235904 -1.038043 1.561955
H -3.416345 -0.136503 2.554491
H 3.901185 -1.640686 -1.744815
H 2.236789 -1.037996 -1.560785
H 3.416441 -0.136509 -2.554313
H -4.521750 -2.414070 -1.938236
H -4.359177 -2.703709 -0.162395
H -6.054696 -1.455334 1.236350
H -7.187804 -0.432723 0.270332
H 4.523678 -2.408383 1.940864
H 4.361343 -2.700063 0.165335
H 6.055888 -1.451862 -1.234744
H 7.188180 -0.427313 -0.269824
H -1.453478 1.163196 -2.024179
H 0.988068 1.164380 -2.287330
H -0.988948 1.166464 2.286111
H 1.452598 1.166959 2.022959


%chk=000116260-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116260

2 1
O -6.121500 -1.291641 -0.898768
O 6.122673 -1.285891 0.899905
N -3.808032 0.025465 0.398655
N 3.808044 0.028122 -0.398571
C -3.709596 -0.778097 -0.921953
C -5.280441 0.502316 0.571104
C 3.710407 -0.773998 0.922975
C 5.280069 0.505899 -0.571741
C -2.923388 1.313852 0.314235
C 2.922389 1.315888 -0.315590
C -3.380473 -0.823170 1.589615
C 3.381039 -0.822236 -1.588506
C -4.784691 -1.875664 -1.009367
C -6.288079 -0.647214 0.406454
C 4.786291 -1.870722 1.011403
C 6.288559 -0.642735 -0.406030
C -1.425214 1.111943 0.152645
C 1.424374 1.112952 -0.153780
C -0.832420 1.102799 -1.138258
C 0.570257 1.104691 -1.288706
C -0.571091 1.105560 1.287580
C 0.831588 1.104674 1.137132
H -2.689615 -1.191511 -0.988498
H -3.870202 -0.049868 -1.735424
H -5.452418 1.256576 -0.215588
H -5.360810 0.980491 1.562774
H 2.690733 -1.188061 0.990181
H 3.870648 -0.044733 1.735590
H 5.451595 1.261133 0.214114
H 5.359933 0.983052 -1.563943
H -3.144431 1.870563 1.241692
H -3.331401 1.886983 -0.535619
H 3.142988 1.871730 -1.243673
H 3.329932 1.890323 0.533613
H -4.035123 -1.700341 1.675673
H -2.341136 -1.150453 1.443530
H -3.460991 -0.217967 2.505959
H 4.036398 -1.698967 -1.673645
H 2.341989 -1.150205 -1.441931
H 3.460963 -0.218021 -2.505554
H -4.737929 -2.337937 -2.008271
H -4.637149 -2.674924 -0.253392
H -6.223826 -1.392281 1.226164
H -7.305898 -0.225919 0.409364
H 4.740046 -2.331930 2.010822
H 4.639137 -2.670895 0.256319
H 6.224684 -1.388704 -1.224945
H 7.306077 -0.220720 -0.409567
H -1.460736 1.158232 -2.034793
H 0.994024 1.161157 -2.298078
H -0.994906 1.162736 2.296892
H 1.459862 1.161569 2.033605


