%chk=000259112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259112

0 1
O -0.539645 2.137581 -0.814652
O 0.386185 -1.234970 -0.782914
N -0.757575 0.756694 -1.090650
N 1.537063 0.730303 -0.295605
C -2.047138 0.340048 -0.558371
C -4.596024 -0.483939 0.251635
C -2.459980 -0.983347 -0.800675
C -2.896976 1.246429 0.092646
C -3.730008 -1.384663 -0.393654
C -4.168449 0.830840 0.490773
C 2.841215 0.199447 -0.027722
C 0.420933 -0.025650 -0.676232
C -5.954281 -0.935814 0.677902
C 3.842041 1.124311 0.338619
C 3.133435 -1.171570 -0.116229
C 5.129012 0.661232 0.612614
C 4.429116 -1.610185 0.162417
C 5.428715 -0.702529 0.525989
H -1.783549 -1.689400 -1.293299
H -2.563803 2.266317 0.287183
H -4.052152 -2.408943 -0.578031
H -4.828040 1.536037 0.993712
H 1.429285 1.751228 -0.216664
H -6.545603 -0.133914 1.138286
H -6.535662 -1.315193 -0.174907
H -5.888722 -1.750399 1.414233
H 3.622624 2.186141 0.411094
H 2.357927 -1.891087 -0.398163
H 5.905911 1.370871 0.896611
H 4.658856 -2.673997 0.094591
H 6.434544 -1.054788 0.741053
H -0.684755 2.567610 -1.722490


%chk=000259112-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259112

0 1
O -0.465924 2.129137 -0.294927
O 0.391553 -1.383277 -0.214596
N -0.701190 0.685021 -0.384230
N 1.627993 0.633510 -0.093557
C -2.066153 0.280003 -0.197868
C -4.817319 -0.454160 0.089298
C -2.482507 -1.051269 -0.477153
C -3.024176 1.238112 0.220678
C -3.838727 -1.397070 -0.321994
C -4.379512 0.865740 0.354855
C 2.965161 0.159144 -0.007256
C 0.467294 -0.120436 -0.217371
C -6.274688 -0.853889 0.241764
C 3.988159 1.139001 0.121204
C 3.313063 -1.217892 -0.045575
C 5.340016 0.750482 0.206094
C 4.672505 -1.589133 0.038858
C 5.693145 -0.618865 0.164015
H -1.745766 -1.793679 -0.785946
H -2.705468 2.255076 0.462687
H -4.142858 -2.429693 -0.533943
H -5.105489 1.619530 0.682843
H 1.481808 1.645976 -0.039187
H -6.902140 0.007747 0.528485
H -6.681176 -1.268273 -0.700147
H -6.399369 -1.632572 1.018110
H 3.722105 2.203623 0.155874
H 2.525672 -1.968450 -0.133388
H 6.116246 1.517482 0.305393
H 4.932947 -2.653315 0.008836
H 6.743329 -0.922327 0.230175
H -0.724033 2.479416 -1.192928


