%chk=000297721.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297721

0 1
S 0.214215 -2.607535 1.594999
O -0.608960 -1.418745 2.664223
O -2.690404 -0.642584 1.171984
N -0.830745 1.783722 1.583306
N -4.267755 -1.169661 -0.467007
N -1.019996 2.809937 1.111825
C 1.571656 -1.575550 0.897118
C 3.727943 -0.053704 -0.174549
C 2.370968 -2.115765 -0.137546
C 1.837986 -0.284346 1.402052
C 3.438706 -1.353734 -0.662855
C 2.906227 0.462979 0.861044
C 4.893377 0.751022 -0.724868
C -3.162447 -1.438138 0.295989
C -4.999738 0.098032 -0.307364
C -4.763687 -2.129374 -1.464648
H 2.169144 -3.117009 -0.537531
H 1.214208 0.108064 2.210368
H 4.052915 -1.779164 -1.466249
H 3.108998 1.466036 1.257998
H -1.392306 -1.039609 2.119412
H 5.766158 0.708938 -0.044274
H 5.222705 0.367628 -1.706583
H 4.628424 1.816970 -0.847686
H -2.697668 -2.422087 0.082674
H -4.486591 0.700662 0.457376
H -6.040344 -0.093098 0.015445
H -5.019876 0.655021 -1.262372
H -4.750914 -1.683287 -2.476913
H -5.800403 -2.435859 -1.230612
H -4.125796 -3.028959 -1.471358


%chk=000297721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297721

0 1
S 0.238310 -2.938748 2.277785
O -0.578639 -1.721147 3.313918
O -2.564555 -0.926272 1.750630
N -0.685760 2.265504 0.918846
N -3.512478 -0.886950 -0.384651
N -1.651677 1.941486 0.398260
C 1.311701 -1.846324 1.246760
C 2.995680 -0.205670 -0.365140
C 2.042489 -2.418210 0.178451
C 1.417272 -0.464238 1.518398
C 2.876473 -1.597142 -0.614201
C 2.246342 0.342180 0.709053
C 3.912454 0.668547 -1.204652
C -2.636855 -1.361838 0.551798
C -4.447174 0.203634 -0.057553
C -3.534010 -1.421032 -1.754734
H 1.970239 -3.491069 -0.038458
H 0.858383 -0.042124 2.359865
H 3.443160 -2.049556 -1.437526
H 2.320027 1.414643 0.928634
H -1.404842 -1.409414 2.779795
H 4.834415 0.929787 -0.649595
H 4.220366 0.158184 -2.134070
H 3.423294 1.619607 -1.484730
H -1.976202 -2.173793 0.186718
H -4.304040 0.476742 0.998463
H -5.489843 -0.126890 -0.217693
H -4.243897 1.086200 -0.689896
H -3.303098 -0.624689 -2.486848
H -4.529355 -1.839588 -1.994796
H -2.782182 -2.221016 -1.859435


