%chk=000249116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249116

0 1
O -0.997261 -2.890443 0.485147
O 3.163917 1.199581 0.004050
O 3.749316 -0.727251 -1.027181
N -0.432356 -0.728611 1.175794
N 1.709500 -2.867737 -0.801315
C 0.668327 0.253757 0.887648
C -1.727178 -0.292204 1.733800
C 1.644120 -0.571138 0.084570
C -0.244947 -1.938795 0.512376
C 1.145108 -1.836326 -0.133686
C -2.609301 0.339387 0.681186
C 2.925579 -0.101980 -0.375719
C -2.817524 1.724476 0.666732
C -3.223011 -0.472335 -0.284608
C -3.643100 2.294132 -0.307983
C -4.044764 0.102123 -1.256645
C -4.256940 1.485401 -1.269051
C 4.449840 1.774179 -0.420407
C 4.415608 3.182961 0.131806
H 1.114356 0.616986 1.837612
H 0.291304 1.128065 0.315035
H -1.531521 0.406782 2.578725
H -2.237012 -1.187553 2.173750
H -2.342235 2.360656 1.410432
H -3.051236 -1.551895 -0.275162
H 2.628205 -2.752871 -1.224716
H 1.234746 -3.751597 -0.894941
H -3.806506 3.370511 -0.317731
H -4.520983 -0.528668 -2.006026
H -4.898889 1.930789 -2.026875
H 5.252806 1.149557 0.007282
H 4.488385 1.730792 -1.522481
H 5.331514 3.730012 -0.120933
H 3.561701 3.748166 -0.266185
H 4.311334 3.182090 1.225399


%chk=000249116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249116

0 1
O -0.750144 -3.217200 0.813320
O 3.121514 1.193658 -0.132263
O 3.908385 -0.956941 -0.661233
N -0.512570 -0.848295 0.990779
N 2.025545 -3.094796 -0.197506
C 0.523228 0.171038 0.716429
C -1.840610 -0.539836 1.532204
C 1.680610 -0.661436 0.196509
C -0.092498 -2.139782 0.691661
C 1.316578 -2.002086 0.185472
C -2.682541 0.343264 0.613008
C 2.977909 -0.198727 -0.233304
C -3.320281 1.503305 1.114565
C -2.857327 -0.003227 -0.751280
C -4.124855 2.304398 0.271078
C -3.657231 0.796115 -1.596047
C -4.294729 1.953096 -1.087095
C 4.440470 1.742692 -0.562503
C 4.365028 3.256451 -0.388845
H 0.781968 0.725568 1.640399
H 0.161177 0.908631 -0.025355
H -1.736243 -0.057000 2.524038
H -2.331777 -1.520513 1.686272
H -3.188231 1.782284 2.167736
H -2.368345 -0.902070 -1.145763
H 2.981696 -2.957821 -0.535740
H 1.589122 -4.014701 -0.135258
H -4.613507 3.199787 0.671454
H -3.787599 0.517484 -2.647801
H -4.916197 2.573046 -1.742865
H 5.230413 1.284101 0.060005
H 4.618396 1.445490 -1.612115
H 5.321822 3.717023 -0.695876
H 3.558639 3.684261 -1.008916
H 4.173086 3.523738 0.664534


