%chk=000291735.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291735

0 1
O 0.770011 2.569472 -0.547912
O 0.977270 -2.360440 1.433397
N -4.788086 -0.169587 0.045261
N -1.366437 1.009218 -1.016833
N 3.420711 -1.223994 0.728886
C -3.470303 0.509445 0.244393
C -2.685966 0.344975 -1.078970
C -5.908729 0.569122 0.715197
C -4.728652 -1.603418 0.490645
C -0.283633 0.456234 -0.373295
C 2.221154 0.759987 0.003111
C 0.934787 1.386512 -0.316563
C 2.269905 -0.575795 0.483001
C 3.444270 1.451360 -0.171159
C -6.224254 1.854986 -0.049993
C -5.850324 -2.400276 -0.176182
C -0.222582 -0.793367 0.156183
C 0.977045 -1.359513 0.756241
C 4.643301 0.772864 0.100082
C 4.608029 -0.560699 0.533242
C 3.478136 2.860982 -0.637118
C 5.853035 -1.328787 0.811244
H -2.882897 0.105024 1.096399
H -3.614239 1.589945 0.460273
H -3.265035 0.787897 -1.922017
H -2.559542 -0.734220 -1.326828
H -6.807286 -0.089900 0.703371
H -5.697550 0.797383 1.782084
H -3.747935 -2.029862 0.181522
H -4.783892 -1.713041 1.595523
H -1.344507 2.011735 -1.221444
H -5.419153 2.593189 0.031095
H -6.365331 1.648123 -1.119748
H -7.142495 2.318733 0.325305
H -6.839563 -2.109020 0.194682
H -5.856239 -2.236690 -1.262532
H -5.727515 -3.473843 0.001916
H -1.088399 -1.454545 0.177852
H 5.598388 1.277812 -0.026908
H 4.489664 3.275714 -0.717519
H 2.988535 2.974947 -1.620432
H 2.896197 3.517636 0.037304
H 6.453427 -0.851682 1.599698
H 5.634639 -2.358051 1.151163
H 6.483743 -1.412967 -0.085718


%chk=000291735-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291735

0 1
O 0.843014 2.450200 -1.140189
O 1.032230 -2.666325 0.862807
N -4.804990 -0.120742 0.154549
N -1.395758 1.045831 -1.076182
N 3.409539 -1.244496 0.768224
C -3.496570 0.564648 0.237704
C -2.741693 0.469598 -1.120320
C -5.889118 0.558787 0.913464
C -4.709654 -1.580207 0.439555
C -0.282743 0.412893 -0.588823
C 2.244600 0.695514 -0.203525
C 0.962369 1.267650 -0.669439
C 2.277018 -0.641042 0.317110
C 3.474380 1.438145 -0.253937
C -6.384073 1.847879 0.230298
C -5.822418 -2.403469 -0.235996
C -0.231071 -0.877890 -0.077933
C 1.003348 -1.480451 0.395038
C 4.634909 0.785654 0.220336
C 4.582587 -0.540008 0.722057
C 3.588464 2.852785 -0.778054
C 5.820366 -1.243951 1.230655
H -2.850810 0.152096 1.048566
H -3.654799 1.632232 0.472759
H -3.333340 0.997302 -1.887350
H -2.676903 -0.589676 -1.434673
H -6.737078 -0.145767 0.985229
H -5.574684 0.782653 1.964056
H -3.732613 -1.936260 0.060996
H -4.705802 -1.777041 1.540965
H -1.229458 2.005963 -1.401746
H -5.583071 2.605022 0.143420
H -6.751859 1.622097 -0.785726
H -7.207098 2.301542 0.813399
H -6.826610 -2.115712 0.124196
H -5.797701 -2.252890 -1.329257
H -5.687301 -3.479871 -0.021944
H -1.125081 -1.504048 -0.001102
H 5.594907 1.313214 0.200685
H 4.633777 3.201360 -0.716715
H 3.242758 2.924684 -1.824054
H 2.941392 3.546111 -0.212945
H 6.280561 -0.688377 2.069197
H 5.551578 -2.253445 1.575642
H 6.586204 -1.328597 0.436902


