%chk=000146744.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000146744

0 1
S -0.869601 -1.569726 -0.122252
P 0.532956 -0.015763 0.105112
O 0.460139 0.742720 -1.366845
O 0.276005 0.804316 1.324394
C 2.127897 -0.884095 -0.044373
C -2.142236 -1.152540 1.139501
C 2.859536 -1.129539 1.118489
C 2.598195 -1.282995 -1.295905
C 4.568272 -2.215503 -0.223863
C -2.963265 -0.012239 0.641959
C 4.082583 -1.798810 1.027704
C 3.822343 -1.950957 -1.385154
C -0.516701 1.805310 -1.534605
C -3.984022 -0.228066 -0.297948
C -2.720895 1.286808 1.118301
C 5.881736 -2.919657 -0.320627
C -0.108532 3.062441 -0.790794
C -4.755478 0.844972 -0.751111
C -3.498186 2.354309 0.663467
C -4.516759 2.136389 -0.270005
H -1.665815 -0.935168 2.119407
H -2.737591 -2.078185 1.275207
H 2.500895 -0.805240 2.101026
H 2.032821 -1.076343 -2.210570
H 4.660015 -1.995120 1.928293
H 4.197600 -2.265101 -2.356430
H -0.471567 1.940079 -2.635840
H -1.527039 1.449036 -1.253506
H -4.171985 -1.230278 -0.679623
H -1.907868 1.464009 1.832534
H 5.927249 -3.607742 -1.175743
H 6.701296 -2.195089 -0.445315
H 6.108029 -3.510382 0.577537
H -0.717615 3.919684 -1.097374
H 0.943858 3.315311 -0.975385
H -0.219647 2.955201 0.301997
H -5.546015 0.673582 -1.479587
H -3.308707 3.358518 1.039301
H -5.123200 2.968954 -0.619975


%chk=000146744-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146744

0 1
S -1.005291 -1.374252 -0.709504
P 0.731483 0.002465 -0.023708
O 0.948165 1.058192 -1.384722
O 0.392946 0.639555 1.411985
C 2.319005 -0.928729 -0.099111
C -2.163866 -1.060540 0.805092
C 2.912830 -1.321024 1.122333
C 2.929396 -1.248065 -1.332836
C 4.758129 -2.377547 -0.123833
C -3.180740 0.026626 0.567001
C 4.125354 -2.041499 1.101447
C 4.141496 -1.969172 -1.336163
C -0.150395 1.992141 -1.766107
C -4.428236 -0.259165 -0.046773
C -2.901250 1.359720 0.970792
C 6.076123 -3.129902 -0.138314
C -0.054402 3.308206 -0.989762
C -5.377293 0.765550 -0.257793
C -3.850938 2.384222 0.760225
C -5.090974 2.091477 0.144770
H -1.484756 -0.810583 1.637649
H -2.621069 -2.049323 0.971969
H 2.433980 -1.055310 2.071138
H 2.470821 -0.925532 -2.272591
H 4.586247 -2.346864 2.048132
H 4.616278 -2.218420 -2.292469
H 0.002721 2.141557 -2.848200
H -1.126545 1.491178 -1.610258
H -4.653461 -1.286082 -0.360650
H -1.936415 1.575427 1.446362
H 6.176101 -3.755859 -1.042153
H 6.930630 -2.425487 -0.130577
H 6.180909 -3.782357 0.745860
H -0.837159 4.005938 -1.342980
H 0.930728 3.781395 -1.143188
H -0.197569 3.139305 0.091102
H -6.338436 0.531840 -0.729773
H -3.627301 3.407860 1.082279
H -5.828543 2.886162 -0.015269


