%chk=000264067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264067

0 1
S 0.460814 1.444074 -0.572029
O 2.936467 2.263901 -0.848984
N -0.810450 -0.787223 0.067107
C -3.422103 0.348114 -0.190043
C -3.264948 -1.049625 0.190353
C -2.263404 1.131371 -0.429242
C -1.952676 -1.577748 0.307951
C -0.976274 0.469722 -0.274501
C -4.697518 0.952567 -0.329317
C -2.397388 2.491300 -0.799723
C -4.362099 -1.909151 0.449177
C -1.751614 -2.935554 0.676474
C -4.809507 2.282123 -0.691944
C -3.653309 3.057490 -0.928925
C -4.156066 -3.228397 0.807011
C -2.843607 -3.744142 0.921206
C 1.817139 0.274340 -0.279220
C 3.050674 1.096974 -0.530966
C 4.381431 0.440441 -0.378567
C 4.525952 -0.905663 -0.012179
C 5.524999 1.222026 -0.616937
C 5.801219 -1.462268 0.113941
C 6.798429 0.662999 -0.490104
C 6.936739 -0.679729 -0.124517
H -5.591973 0.356217 -0.146937
H -1.510921 3.102613 -0.986022
H -5.376215 -1.516264 0.362486
H -0.732037 -3.312168 0.758583
H -5.791583 2.743324 -0.798029
H -3.759453 4.103391 -1.213819
H -5.002611 -3.884028 1.004643
H 1.771980 -0.136600 0.750712
H 1.736288 -0.604295 -0.952343
H -2.705099 -4.787142 1.204615
H 3.651312 -1.528285 0.176955
H 5.402840 2.271912 -0.902528
H 5.911350 -2.507682 0.398534
H 7.681352 1.273103 -0.675956
H 7.929872 -1.117840 -0.025016


%chk=000264067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264067

0 1
S 0.399068 1.811755 -0.701796
O 3.222895 2.496146 -0.937571
N -0.740106 -0.580840 -0.013648
C -3.460942 0.347685 -0.186307
C -3.181130 -1.040485 0.187368
C -2.353044 1.226963 -0.462526
C -1.803470 -1.452718 0.258763
C -1.003394 0.674764 -0.351266
C -4.783046 0.875083 -0.290080
C -2.597633 2.583546 -0.828175
C -4.189713 -2.003196 0.484032
C -1.477609 -2.792599 0.618238
C -5.004686 2.211021 -0.650772
C -3.906277 3.073836 -0.922443
C -3.854277 -3.319097 0.836944
C -2.489234 -3.718724 0.905075
C 1.797243 0.594516 -0.394550
C 3.143987 1.279163 -0.600537
C 4.378203 0.448725 -0.386333
C 4.325603 -0.922537 -0.015098
C 5.643507 1.072536 -0.564410
C 5.517660 -1.653288 0.174136
C 6.832119 0.341658 -0.374455
C 6.771966 -1.024132 -0.004422
H -5.643794 0.231166 -0.085735
H -1.752214 3.247850 -1.036872
H -5.246948 -1.722372 0.439245
H -0.418172 -3.063809 0.660251
H -6.028692 2.593319 -0.723868
H -4.084217 4.116937 -1.203849
H -4.646313 -4.041885 1.060891
H 1.693630 0.201558 0.631206
H 1.666583 -0.261839 -1.077854
H -2.233100 -4.747364 1.181023
H 3.362594 -1.424387 0.127293
H 5.660445 2.129341 -0.851004
H 5.471287 -2.709638 0.460163
H 7.803077 0.829392 -0.512890
H 7.696148 -1.593849 0.143734


