%chk=000237970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237970

0 1
S 3.527843 1.456404 1.503092
S 0.687644 1.674485 2.479108
O -1.728581 -0.815183 -1.233040
O -1.770690 1.567747 3.057643
N -1.345162 0.400901 1.082187
N 1.533696 0.256893 0.302090
C 3.903825 0.500521 0.090709
C 2.709626 -0.073941 -0.426566
C -2.677830 -0.032123 0.764253
C -2.883084 -0.693609 -0.486406
C 5.137209 0.272165 -0.511003
C 2.754658 -0.893310 -1.565279
C 1.795231 1.032140 1.317889
C -3.774900 0.154494 1.609154
C -4.144676 -1.149958 -0.860802
C 5.170030 -0.543000 -1.643704
C 3.993167 -1.117519 -2.161819
C -5.044020 -0.304250 1.227884
C -5.227615 -0.949616 0.008040
C -1.044893 1.153394 2.187413
C -1.826326 -1.460760 -2.525256
H 6.049590 0.713620 -0.112913
H 1.839529 -1.334540 -1.956032
H -3.650846 0.662556 2.573023
H -0.609307 0.112600 0.402431
H -4.302453 -1.653954 -1.809315
H 6.121077 -0.741013 -2.137721
H 4.057767 -1.750469 -3.047384
H -5.887373 -0.149056 1.899355
H -6.216279 -1.304016 -0.281536
H -2.499206 -0.899784 -3.180575
H -2.141009 -2.501563 -2.406037
H -0.789142 -1.398455 -2.880382


%chk=000237970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237970

0 1
S 3.535109 1.702917 1.327716
S 0.694794 2.060386 2.602400
O -1.362141 -0.585933 -1.186424
O -1.942772 1.751694 3.173360
N -1.276044 0.543442 1.240889
N 1.352211 0.370644 0.496951
C 3.683006 0.500045 -0.029159
C 2.410821 -0.096706 -0.306792
C -2.523323 -0.021783 0.830069
C -2.567534 -0.630379 -0.462921
C 4.838844 0.139175 -0.746557
C 2.303059 -1.086633 -1.310319
C 1.741505 1.270075 1.381168
C -3.697948 -0.003311 1.619670
C -3.761121 -1.212977 -0.939436
C 4.712521 -0.844521 -1.754610
C 3.458587 -1.453383 -2.028525
C -4.890995 -0.586862 1.136778
C -4.924939 -1.192070 -0.136106
C -1.120982 1.353694 2.323960
C -1.398693 -1.017058 -2.586395
H 5.809814 0.596902 -0.535210
H 1.332634 -1.556435 -1.491012
H -3.675167 0.476098 2.600092
H -0.411274 0.314182 0.676423
H -3.792900 -1.679882 -1.928128
H 5.598072 -1.143342 -2.325288
H 3.392235 -2.222461 -2.805498
H -5.790029 -0.563160 1.760885
H -5.848677 -1.645350 -0.510896
H -2.162623 -0.453412 -3.154988
H -1.598984 -2.103081 -2.668088
H -0.399563 -0.788716 -2.985508


