%chk=000270227.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270227

0 1
S 2.364272 -1.338111 0.759563
O 3.374081 -1.591501 -0.232818
O 2.425994 -2.035699 2.031586
O -3.990093 -0.562480 1.911476
N 2.525685 0.309519 1.339265
N -4.325797 -0.060427 -0.287422
N 2.090345 1.227731 -0.779659
C -3.151512 -1.849784 -1.598291
C -1.791469 -1.694077 -0.975215
C 0.790307 -1.460448 0.101721
C -4.340557 -1.483076 -0.695873
C -0.694861 -1.422747 -1.812756
C -1.583615 -1.849576 0.404734
C 0.587522 -1.304749 -1.275110
C -0.300873 -1.734672 0.937373
C 2.469262 1.444211 0.526701
C -4.077524 0.293755 1.046315
C 2.763867 2.740313 1.028237
C -3.982321 1.769420 1.308410
C 2.676778 3.817268 0.153572
C 2.021408 2.304703 -1.603064
C 2.302805 3.610779 -1.181748
H -3.263664 -2.913057 -1.914732
H -3.208367 -1.264409 -2.540503
H -5.293836 -1.684164 -1.236311
H -4.350180 -2.125538 0.221367
H -0.837971 -1.303796 -2.884385
H -2.428796 -2.042182 1.075748
H 1.439492 -1.087052 -1.932775
H -0.148852 -1.868874 2.015273
H 2.800738 0.457363 2.319889
H -4.279572 0.623784 -1.032402
H 3.056960 2.881700 2.062863
H -3.924768 1.952084 2.395083
H -3.079212 2.209064 0.864332
H -4.851760 2.325729 0.936094
H 2.901900 4.825021 0.505889
H 1.727089 2.088552 -2.637383
H 2.239098 4.442025 -1.875443


%chk=000270227-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270227

0 1
S 2.297126 -1.050048 0.883135
O 3.427324 -1.501686 -0.185199
O 2.260999 -1.689961 2.380713
O -4.579898 -1.161923 2.043311
N 2.444176 0.766319 1.325175
N -4.743578 -0.411661 -0.154256
N 2.504017 1.516805 -0.908890
C -3.297674 -1.838175 -1.661028
C -1.947368 -1.593690 -0.991587
C 0.586556 -1.221204 0.119712
C -4.550305 -1.737828 -0.760074
C -0.843504 -1.220543 -1.806080
C -1.743429 -1.772639 0.401756
C 0.443197 -1.028997 -1.261937
C -0.463444 -1.589412 0.972760
C 2.845643 1.734148 0.397527
C -4.752421 -0.209800 1.219520
C 3.526054 2.911930 0.830306
C -4.972649 1.228613 1.675030
C 3.829951 3.896282 -0.127827
C 2.832528 2.475450 -1.819241
C 3.482944 3.682854 -1.484950
H -3.297827 -2.857986 -2.100431
H -3.404741 -1.145978 -2.520501
H -5.439254 -2.002478 -1.365985
H -4.503243 -2.453475 0.078321
H -0.991364 -1.076940 -2.883323
H -2.576715 -2.040595 1.060307
H 1.298865 -0.723026 -1.869439
H -0.285432 -1.742223 2.041807
H 2.782060 0.821447 2.295575
H -4.864522 0.393036 -0.771240
H 3.800378 3.043559 1.882039
H -5.821160 1.255841 2.379500
H -4.079819 1.572078 2.225876
H -5.171155 1.930386 0.846407
H 4.345562 4.812765 0.178183
H 2.557295 2.255701 -2.857207
H 3.716831 4.419660 -2.258164


