%chk=000282340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282340

0 1
S 0.169629 4.559956 -0.466875
S -5.231466 -2.461611 -0.572450
F -5.761895 -2.900980 0.854501
O -3.178801 3.951630 0.336505
O -6.424590 -2.065829 -1.259472
O -4.433971 -3.580816 -0.981938
N 3.203838 -0.581444 -0.185376
N 3.266791 -2.896487 0.775388
N 5.320397 -1.703064 0.195474
N 5.336891 0.515801 -0.574164
N 5.373302 -3.707159 1.474490
N -1.768530 2.165861 0.733778
C 2.415324 -1.886002 0.142725
C 1.287137 -1.544136 1.123926
C 1.888032 -2.433329 -1.191389
C 2.499523 0.669337 -0.253396
C 4.619643 -0.629989 -0.179802
C 4.583083 -2.775947 0.791171
C 1.444532 0.813814 -1.175216
C 2.850027 1.737313 0.597917
C 0.733983 2.012223 -1.230221
C 2.136031 2.933068 0.534680
C 1.072731 3.056534 -0.364271
C -0.919386 4.457969 0.976339
C -2.635076 1.091948 0.404236
C -2.078001 3.555411 0.642411
C -4.249732 -1.115870 -0.198040
C -2.079257 -0.211772 0.397422
C -3.997606 1.280914 0.096592
C -2.891365 -1.298706 0.100246
C -4.790942 0.178884 -0.200609
H 0.851039 -2.479308 1.514563
H 1.661068 -0.999605 1.999886
H 0.475273 -0.964553 0.665715
H 1.353134 -3.379957 -1.021626
H 1.199854 -1.739951 -1.688468
H 2.702585 -2.657764 -1.890876
H 1.187488 -0.014038 -1.843912
H 3.677440 1.627776 1.302669
H -0.083133 2.126909 -1.948714
H 2.411096 3.763424 1.189506
H 6.340361 0.382848 -0.688863
H 4.923952 1.117382 -1.274890
H 4.954889 -4.607899 1.667332
H 6.359021 -3.726972 1.249291
H -1.298567 5.492025 1.164141
H -0.379604 4.168900 1.896404
H -0.807305 1.901336 0.982820
H -1.018852 -0.373332 0.618463
H -4.429234 2.289867 0.087415
H -2.461031 -2.308829 0.090452
H -5.851053 0.328719 -0.445988


%chk=000282340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282340

0 1
S 0.177401 4.580665 -0.660923
S -5.696030 -2.378357 -0.102042
F -5.987507 -2.756781 1.697819
O -3.370539 4.195951 0.704331
O -7.123104 -1.923690 -0.684581
O -4.888331 -3.641266 -0.684293
N 3.333791 -0.645691 -0.152216
N 3.366851 -2.938619 0.791093
N 5.431232 -1.652140 0.488985
N 5.404271 0.531303 -0.320519
N 5.390494 -3.593983 1.783302
N -1.949538 2.323721 0.581087
C 2.700021 -2.064032 -0.188483
C 1.213302 -1.991201 0.210405
C 2.878325 -2.651180 -1.615181
C 2.577854 0.562550 -0.270417
C 4.725875 -0.621983 0.019466
C 4.660639 -2.727207 0.993743
C 1.713539 0.797934 -1.374301
C 2.680811 1.563365 0.741057
C 0.959496 1.989380 -1.456101
C 1.958611 2.767932 0.639342
C 1.081321 2.984382 -0.454420
C -0.959666 4.553972 0.876598
C -2.871393 1.264495 0.422784
C -2.211027 3.694476 0.707422
C -4.566718 -0.919775 0.112742
C -2.334625 -0.052427 0.321910
C -4.280754 1.467792 0.362741
C -3.182206 -1.161207 0.170911
C -5.136751 0.360767 0.210658
H 0.862257 -3.029210 0.326378
H 1.102627 -1.485792 1.185522
H 0.591429 -1.488578 -0.549452
H 2.493796 -3.685485 -1.627651
H 2.331119 -2.062934 -2.374842
H 3.948028 -2.679179 -1.888368
H 1.639364 0.055163 -2.174064
H 3.339887 1.388462 1.597497
H 0.288087 2.157191 -2.304471
H 2.080060 3.541969 1.405492
H 6.407373 0.536469 -0.150657
H 4.967512 1.279317 -0.852543
H 4.934901 -4.413408 2.174479
H 6.366221 -3.385296 1.971867
H -1.274631 5.597895 1.016800
H -0.351722 4.233538 1.739755
H -0.957593 2.062408 0.544578
H -1.250785 -0.207541 0.368900
H -4.681293 2.479533 0.439680
H -2.782278 -2.176467 0.090920
H -6.221307 0.497299 0.157160


