%chk=000266680.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266680

0 1
S -1.103269 -0.968868 -1.062795
O 2.563751 1.337715 1.195424
O -0.050255 0.069529 -0.233771
O 2.001291 -2.355579 -0.547862
O 2.782495 1.740730 -1.093289
O -0.707574 -2.300240 -0.634782
O -1.022805 -0.611243 -2.451414
N 4.331657 -0.821726 -0.633782
C 3.484738 -0.915890 0.579387
C 1.982867 -1.188342 0.272173
C 1.356609 -0.018216 -0.518525
C 3.590764 0.343384 1.474332
C 1.888819 1.355475 -0.040204
C 4.939832 1.039233 1.420459
C -2.579660 -0.497547 -0.354318
C 3.293423 3.085975 -0.988648
C -3.356343 0.505902 -0.951568
C -3.021701 -1.109581 0.827195
C -4.561606 0.896863 -0.373257
C -4.226597 -0.721890 1.409253
C -5.005667 0.287917 0.815242
C -6.300345 0.696916 1.429192
H 3.872522 -1.798202 1.162058
H 1.402161 -1.382577 1.199813
H 1.515583 -0.138976 -1.619052
H 3.322415 0.077162 2.526881
H 1.088085 2.107723 0.130544
H 5.135356 1.462106 0.424784
H 5.757403 0.334772 1.621612
H 4.991618 1.858976 2.144407
H 4.109912 0.024445 -1.164269
H 4.140504 -1.620107 -1.242120
H 1.092991 -2.786357 -0.571588
H 4.081932 3.107873 -1.749605
H 3.702880 3.261667 0.012567
H 2.496956 3.796928 -1.225385
H -3.018980 0.981206 -1.880787
H -2.422243 -1.901060 1.292773
H -5.161288 1.675361 -0.843115
H -4.565087 -1.202542 2.326236
H -7.131525 0.099281 1.020085
H -6.315435 0.557975 2.519871
H -6.544084 1.752330 1.239646


%chk=000266680-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266680

0 1
S -1.119317 -1.041510 -1.002567
O 2.801619 1.355711 1.282363
O -0.011124 0.028890 0.067991
O 1.990147 -2.470628 -0.260350
O 2.760286 1.796459 -1.107032
O -0.827927 -2.594307 -0.590208
O -0.979867 -0.586105 -2.549137
N 4.314889 -0.765068 -0.817095
C 3.669221 -0.909494 0.496932
C 2.138075 -1.197551 0.432523
C 1.430716 -0.040751 -0.301052
C 3.884564 0.308951 1.432674
C 2.009990 1.351008 0.077175
C 5.258963 0.972754 1.320182
C -2.752280 -0.498820 -0.288966
C 3.200001 3.198153 -1.010863
C -3.430050 0.546960 -0.935726
C -3.239128 -1.165001 0.846740
C -4.675189 0.941358 -0.401778
C -4.486833 -0.747548 1.357801
C -5.219650 0.304990 0.746276
C -6.573609 0.720387 1.288870
H 4.123186 -1.787500 0.993996
H 1.725983 -1.250600 1.464648
H 1.524863 -0.168740 -1.397391
H 3.723139 -0.033649 2.472643
H 1.189460 2.062085 0.295170
H 5.469809 1.286679 0.286009
H 6.044979 0.251260 1.609164
H 5.311678 1.844776 1.995704
H 4.028794 0.085402 -1.320234
H 4.209911 -1.612917 -1.383925
H 1.020451 -2.715123 -0.339658
H 3.738721 3.408486 -1.947350
H 3.867176 3.347116 -0.142773
H 2.325014 3.873288 -0.922509
H -3.007347 1.022845 -1.826098
H -2.674135 -1.983806 1.302165
H -5.229673 1.754830 -0.882663
H -4.894708 -1.246671 2.243696
H -7.383128 0.143766 0.800921
H -6.650463 0.538818 2.374537
H -6.775108 1.789322 1.102993


