%chk=000297973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297973

0 1
S 2.099564 -1.640086 0.365219
O 2.958199 -1.966315 1.482600
O 1.740675 -2.625978 -0.622560
N 0.648706 -1.125340 1.186965
N -5.349113 0.246584 -1.741050
C -0.612629 -0.898483 0.609875
C -1.630995 -0.220294 1.392663
C -2.879616 0.077323 0.786829
C 2.645353 -0.209186 -0.403170
C -0.886364 -1.288638 -0.697312
C -3.107891 -0.308054 -0.579742
C -1.422410 0.159552 2.755274
C -2.128971 -0.988074 -1.286044
C -3.883304 0.752979 1.552634
C 3.556234 0.629831 0.252431
C 2.199522 0.123310 -1.689629
C 3.554838 2.136367 -1.649063
C -2.400457 0.804380 3.470596
C 4.008679 1.795921 -0.362330
C 2.646912 1.287566 -2.309652
C -3.649394 1.106166 2.857711
C 4.027075 3.381084 -2.318627
C -4.347667 -0.001681 -1.216096
H 0.696792 -1.022440 2.214423
H -0.173852 -1.885477 -1.277002
H -0.467145 -0.072550 3.230089
H -2.311958 -1.305748 -2.316288
H -4.841455 0.980180 1.081842
H 3.923938 0.365471 1.251446
H 1.500237 -0.535764 -2.217103
H 4.716847 2.441532 0.154977
H 2.294357 1.541315 -3.308589
H -2.239368 1.090979 4.508444
H -4.413217 1.618971 3.443048
H 4.721354 3.968231 -1.701842
H 4.549955 3.155921 -3.261537
H 3.185869 4.045045 -2.572829


%chk=000297973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297973

0 1
S 2.112888 -1.748227 0.375789
O 3.052169 -2.068445 1.661953
O 1.825173 -2.859741 -0.773848
N 0.575573 -1.224795 1.226015
N -5.467338 0.429089 -1.665887
C -0.653549 -0.900377 0.626341
C -1.651126 -0.222963 1.439743
C -2.929209 0.109009 0.849803
C 2.682568 -0.168638 -0.475951
C -0.924412 -1.187604 -0.724733
C -3.166290 -0.191091 -0.546248
C -1.412257 0.126879 2.808703
C -2.163681 -0.820532 -1.304306
C -3.924429 0.742809 1.662131
C 3.297571 0.814584 0.313792
C 2.514931 -0.061957 -1.865698
C 3.584800 2.158440 -1.736801
C -2.400833 0.747157 3.577199
C 3.745629 1.985885 -0.336212
C 2.971216 1.119439 -2.487632
C -3.671589 1.049090 3.000993
C 4.066617 3.420340 -2.427232
C -4.420624 0.145229 -1.157831
H 0.646612 -1.486527 2.214999
H -0.199065 -1.750420 -1.318355
H -0.432758 -0.062390 3.260485
H -2.353677 -1.058692 -2.355296
H -4.893234 0.986642 1.212457
H 3.437997 0.667627 1.389264
H 2.065882 -0.879239 -2.438441
H 4.229408 2.772680 0.252853
H 2.852725 1.233223 -3.571210
H -2.198959 1.011617 4.620485
H -4.444086 1.531775 3.608679
H 4.523436 4.126645 -1.714430
H 4.819339 3.187083 -3.202928
H 3.231878 3.940994 -2.932046


