%chk=000297448.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297448

0 1
O -2.801183 -1.655669 0.861189
N -1.587358 -0.064183 -0.376248
C 0.708195 -0.031162 0.683577
C 1.472715 0.672391 -0.474154
C -0.780467 0.429192 0.762649
C 0.847637 -1.569790 0.603498
C 1.353242 2.212746 -0.363805
C 2.953913 0.218508 -0.503129
C -0.869733 1.973631 0.864958
C -0.117602 2.684633 -0.286526
C 2.330411 -2.006202 0.579415
C 3.094522 -1.319833 -0.577945
C -2.551250 -1.061671 -0.251430
C -3.308417 -1.377814 -1.545311
H 1.181644 0.305446 1.634743
H 1.006416 0.351746 -1.434853
H -1.242936 -0.032906 1.654663
H 0.343668 -1.930258 -0.316540
H 0.314416 -2.037209 1.453616
H 1.866683 2.691784 -1.221399
H 1.887615 2.544585 0.551836
H 3.456284 0.585829 0.417439
H 3.473038 0.695227 -1.359119
H -0.416011 2.280286 1.829016
H -1.932169 2.281413 0.892154
H -0.161772 3.781224 -0.141744
H -0.624172 2.486065 -1.255674
H 2.401692 -3.107309 0.486533
H 2.809924 -1.734592 1.543212
H 4.164421 -1.605493 -0.555721
H 2.686959 -1.679081 -1.545926
H -1.441323 0.363063 -1.292328
H -3.873117 -2.311209 -1.405682
H -4.024847 -0.569540 -1.782888
H -2.624942 -1.494948 -2.406474


%chk=000297448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297448

0 1
O -2.849771 -1.554834 0.858716
N -1.585511 -0.041215 -0.386649
C 0.703662 -0.024575 0.684113
C 1.480357 0.663767 -0.474736
C -0.780475 0.452283 0.753582
C 0.826659 -1.565079 0.615473
C 1.377929 2.205720 -0.372195
C 2.956251 0.192073 -0.496714
C -0.854695 1.998006 0.846246
C -0.087932 2.694860 -0.304234
C 2.304477 -2.018789 0.596320
C 3.078268 -1.348026 -0.563735
C -2.570219 -1.008727 -0.253117
C -3.303272 -1.380772 -1.541794
H 1.175933 0.313801 1.635068
H 1.013733 0.343983 -1.435613
H -1.253489 0.000180 1.645386
H 0.319700 -1.927273 -0.302197
H 0.288015 -2.019955 1.469081
H 1.900657 2.674658 -1.229733
H 1.911899 2.535907 0.544249
H 3.460051 0.557935 0.423651
H 3.483639 0.658481 -1.353305
H -0.404863 2.305300 1.811902
H -1.914240 2.315977 0.864106
H -0.119813 3.792434 -0.163998
H -0.592273 2.498069 -1.274839
H 2.363016 -3.121144 0.509829
H 2.785701 -1.747250 1.559265
H 4.144530 -1.646646 -0.538917
H 2.667217 -1.706886 -1.530370
H -1.415819 0.361333 -1.309435
H -3.149902 -2.454822 -1.745836
H -4.386405 -1.229233 -1.394931
H -2.976919 -0.800637 -2.423037


