%chk=000280392.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280392

0 1
S 1.753924 -2.125267 -0.036432
O 1.689348 -2.610628 -1.392810
O 2.361591 -2.967494 0.979534
N -0.628317 -1.099791 -0.177941
N 0.138337 -1.935510 0.595551
C -4.047507 0.149813 -0.062645
C -2.734840 -0.044116 -0.878387
C -4.247954 -1.218085 0.638192
C -3.962562 1.276154 0.982224
C -2.039606 1.257230 -1.292515
C -1.912680 -1.002632 -0.026149
C -2.831835 -1.761844 0.908538
C -3.369392 2.563666 0.401175
C -1.970697 2.291210 -0.164748
C 2.432350 -0.550153 0.012803
C 3.319696 -0.205709 1.040244
C 2.105261 0.390710 -0.970509
C 3.883635 1.068197 1.082753
C 2.665795 1.668059 -0.933212
C 3.560478 2.014832 0.093522
C 4.152059 3.383696 0.144039
H -4.885403 0.364969 -0.759089
H -2.990131 -0.603215 -1.818176
H -4.811200 -1.906166 -0.015428
H -4.833508 -1.127234 1.566143
H -3.338451 0.945001 1.836528
H -4.968704 1.473341 1.395583
H -2.581005 1.689654 -2.157074
H -1.016484 1.029373 -1.654250
H -2.776311 -2.850829 0.734472
H -2.537039 -1.591597 1.961270
H -3.319260 3.342482 1.184501
H -4.028932 2.966733 -0.390342
H -1.517244 3.227660 -0.537071
H -1.302136 1.921292 0.638001
H -0.298366 -2.679269 1.157369
H 3.576083 -0.942838 1.811435
H 1.407020 0.125211 -1.773046
H 4.573968 1.329025 1.882277
H 2.408239 2.394410 -1.701084
H 4.262975 3.831584 -0.853405
H 3.512603 4.061200 0.731632
H 5.146602 3.395676 0.611629


%chk=000280392-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280392

0 1
S 1.758113 -2.107906 -0.226563
O 1.619319 -2.440644 -1.813387
O 2.426912 -3.164558 0.816265
N -0.765464 -1.009937 -0.249543
N 0.040064 -1.762472 0.600153
C -4.206711 0.091138 0.079813
C -2.998448 -0.126302 -0.886828
C -4.318671 -1.282295 0.806348
C -3.944527 1.251698 1.075862
C -2.383464 1.157213 -1.487917
C -2.060572 -0.990738 -0.047216
C -2.843788 -1.725708 1.038246
C -3.463491 2.537806 0.364869
C -2.164680 2.262157 -0.428953
C 2.567057 -0.426519 -0.046368
C 3.225060 -0.133188 1.157974
C 2.507299 0.455181 -1.135990
C 3.854263 1.125938 1.268718
C 3.143493 1.708338 -0.997340
C 3.816279 2.063580 0.201940
C 4.469331 3.425973 0.347390
H -5.123755 0.317732 -0.497690
H -3.352987 -0.766663 -1.726411
H -4.834281 -2.014256 0.156338
H -4.888535 -1.214065 1.750067
H -3.166317 0.944493 1.805189
H -4.866595 1.446197 1.658106
H -3.064728 1.540371 -2.274436
H -1.426463 0.898861 -1.977751
H -2.715670 -2.826292 0.981748
H -2.469548 -1.420303 2.036226
H -3.298151 3.341721 1.108108
H -4.251655 2.898048 -0.329128
H -1.811997 3.186571 -0.925781
H -1.365513 1.948951 0.272004
H -0.303532 -2.709008 0.884981
H 3.260351 -0.870806 1.965994
H 1.998300 0.159762 -2.058404
H 4.383388 1.381484 2.193881
H 3.117753 2.417913 -1.832301
H 4.820246 3.813904 -0.624522
H 3.751211 4.163319 0.755764
H 5.331502 3.392114 1.035645


