%chk=000273670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273670

0 1
S -2.931918 1.857638 0.587593
S -3.029632 -0.653571 -0.946115
N -0.063842 1.818373 0.276209
C 0.448011 -0.512592 -0.264937
C 0.369155 -1.295949 1.078116
C -0.682880 0.606301 -0.377578
C -2.027340 0.288738 0.274749
C 0.379685 -1.427463 -1.498870
C -1.068782 -1.716706 1.420154
C -1.956906 -0.477254 1.577305
C 1.702613 0.353768 -0.219313
C 1.317039 -2.510311 1.091494
C 1.347403 -2.614531 -1.425538
C 1.147015 -3.414090 -0.133804
C 1.346066 1.695952 0.111057
C 3.032448 0.024137 -0.392600
C -4.227980 1.749786 -0.691655
C -4.583401 0.298391 -0.877671
C 2.308498 2.687313 0.283195
C 4.014842 1.021045 -0.227062
C 3.655388 2.323530 0.114232
H 0.712592 -0.594204 1.885249
H -0.847459 0.816449 -1.470792
H 0.589213 -0.838242 -2.412582
H -0.652653 -1.815755 -1.613208
H -1.077692 -2.299823 2.360625
H -1.471332 -2.398028 0.645855
H -2.965919 -0.769964 1.931778
H -1.538824 0.177169 2.377268
H 1.158377 -3.096082 2.016389
H 2.363344 -2.148766 1.144904
H 2.395268 -2.250404 -1.482695
H 1.201703 -3.267940 -2.305858
H -0.478771 2.712267 0.013022
H 0.140747 -3.875551 -0.127602
H 1.867449 -4.251819 -0.088884
H 3.320588 -0.993912 -0.663798
H -3.867618 2.218822 -1.628101
H -5.087632 2.353131 -0.336217
H -5.221578 -0.088808 -0.058790
H -5.123983 0.111822 -1.827335
H 2.035822 3.702789 0.547098
H 5.061407 0.764674 -0.366278
H 4.427071 3.080768 0.248489


%chk=000273670-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273670

0 1
S -2.994883 1.992443 0.469995
S -3.002763 -0.653211 -1.141054
N 0.021028 1.780900 0.353391
C 0.489656 -0.487888 -0.297829
C 0.386190 -1.275189 1.070462
C -0.613814 0.656141 -0.383679
C -2.021725 0.333115 0.186461
C 0.369132 -1.445256 -1.517768
C -1.071973 -1.667316 1.417216
C -1.975095 -0.421667 1.523638
C 1.769570 0.378199 -0.250909
C 1.335448 -2.501174 1.084071
C 1.261803 -2.709312 -1.451706
C 1.100212 -3.457757 -0.108485
C 1.415320 1.687614 0.193718
C 3.125385 0.073069 -0.463815
C -4.374921 1.710603 -0.788761
C -4.653750 0.209008 -0.839851
C 2.387290 2.682825 0.430688
C 4.117241 1.067990 -0.246199
C 3.746467 2.356243 0.202884
H 0.723891 -0.577177 1.864659
H -0.739810 0.927121 -1.457528
H 0.589222 -0.875708 -2.441301
H -0.683611 -1.781500 -1.603410
H -1.077786 -2.203687 2.386305
H -1.495199 -2.360132 0.664890
H -3.002137 -0.693550 1.826001
H -1.570515 0.263955 2.295354
H 1.203378 -3.045197 2.040633
H 2.385916 -2.150280 1.065211
H 2.324835 -2.436154 -1.592463
H 1.000243 -3.377223 -2.295498
H -0.453215 2.686964 0.320191
H 0.083826 -3.895907 -0.048080
H 1.811514 -4.304951 -0.058003
H 3.434479 -0.919217 -0.805303
H -4.061917 2.096268 -1.771478
H -5.245795 2.278335 -0.416265
H -5.097339 -0.157147 0.100480
H -5.301116 -0.066073 -1.690700
H 2.101256 3.683315 0.774372
H 5.171829 0.833138 -0.426041
H 4.517834 3.116527 0.373007


