%chk=000181393.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181393

0 1
S -1.793284 -4.041276 -1.533209
N -0.914465 -1.603575 -0.552600
C 1.454320 1.395544 -0.207066
C 0.933616 -0.011150 -0.636097
C -0.467123 -0.317106 -0.032103
C -1.515635 0.772973 -0.385962
C 0.374351 2.464502 -0.505109
C -0.988303 2.130128 0.107475
C 1.808178 1.406854 1.299825
C 1.921020 -1.085722 -0.221690
C 2.799118 0.300414 1.680483
C 2.703117 1.734232 -1.044154
C -2.920756 0.442271 0.194052
C 2.315538 -1.085836 1.231429
C -2.944350 0.416637 1.725463
C -3.965900 1.427512 -0.345721
C 2.398785 -1.974559 -1.095489
C -1.274854 -2.641282 -0.971746
H 0.835966 -0.007193 -1.751913
H -0.388003 -0.425792 1.085605
H -1.617056 0.816621 -1.499210
H 0.266280 2.585301 -1.600794
H 0.715388 3.448468 -0.131831
H -0.922190 2.140072 1.212391
H -1.716121 2.922739 -0.157723
H 0.884543 1.301109 1.900118
H 2.232392 2.391083 1.573488
H 2.958307 0.302786 2.775720
H 3.788300 0.510261 1.228486
H 3.487423 0.978567 -0.913802
H 2.479359 1.779472 -2.114941
H 3.129787 2.699989 -0.755684
H -3.206946 -0.577618 -0.170299
H 1.450030 -1.407434 1.846203
H 3.108065 -1.836099 1.425747
H -2.738893 1.400962 2.157541
H -3.931425 0.107142 2.096133
H -2.218167 -0.293720 2.132058
H -3.760327 2.457812 -0.037485
H -4.968375 1.176670 0.022393
H -4.009950 1.407152 -1.439998
H 2.116493 -2.000847 -2.136532
H 3.099649 -2.750365 -0.827851


%chk=000181393-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181393

0 1
S -1.484930 -4.036343 -1.724992
N -0.963965 -1.608641 -0.340819
C 1.472249 1.394343 -0.203237
C 0.918792 -0.031598 -0.586157
C -0.495418 -0.302753 0.053625
C -1.536074 0.798872 -0.322964
C 0.383250 2.475007 -0.467842
C -0.991409 2.163548 0.161455
C 1.909429 1.413369 1.295646
C 1.917791 -1.122496 -0.201221
C 2.912318 0.292869 1.660850
C 2.690763 1.713488 -1.110021
C -2.978371 0.467895 0.179445
C 2.374690 -1.105627 1.250722
C -3.101764 0.395856 1.721549
C -4.017870 1.456242 -0.403148
C 2.372072 -2.032367 -1.100363
C -1.159364 -2.626964 -0.957932
H 0.767731 -0.056303 -1.685790
H -0.396189 -0.314868 1.157294
H -1.581078 0.826736 -1.434792
H 0.251687 2.579472 -1.565204
H 0.755211 3.452904 -0.100602
H -0.919993 2.174094 1.266602
H -1.703999 2.963509 -0.112449
H 1.020703 1.318693 1.951039
H 2.354831 2.403322 1.520102
H 3.110186 0.310796 2.750055
H 3.881543 0.473251 1.158619
H 3.488630 0.957332 -1.019909
H 2.385944 1.745170 -2.173341
H 3.116808 2.701179 -0.850243
H -3.224326 -0.537466 -0.218805
H 1.520390 -1.362278 1.913064
H 3.145324 -1.880271 1.416804
H -2.899663 1.375380 2.193400
H -4.127358 0.097594 2.006449
H -2.411543 -0.347970 2.159874
H -3.899924 2.472480 0.017196
H -5.044061 1.119595 -0.166659
H -3.932355 1.529276 -1.503799
H 2.030374 -2.034999 -2.142397
H 3.086842 -2.813631 -0.815500


