%chk=000203047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203047

0 1
O -2.610585 -2.094684 0.841776
O -1.603514 0.608790 -1.491578
O 2.180526 2.667144 -0.011540
N 0.223127 1.672046 -0.649676
C -0.178651 -0.761369 -0.056094
C -0.794458 -1.978482 -0.777226
C -0.698324 -0.659369 1.400096
C -2.319385 -2.062840 -0.579170
C -2.206299 -0.929811 1.578383
C 1.339060 -0.878946 0.026450
C -0.603328 0.517897 -0.811671
C 2.144642 0.271956 -0.004264
C -2.903882 -3.371598 -1.091612
C -3.093195 0.265312 1.254416
C 1.571191 1.630937 -0.186903
C 1.954308 -2.125882 0.209594
C -0.359720 3.005334 -1.006862
C 3.538811 0.172921 0.134718
C 3.341540 -2.224354 0.339367
C 4.138480 -1.075038 0.302416
C -0.959856 3.648259 0.215382
C -2.246257 3.973936 0.307283
H -0.337123 -2.911787 -0.385122
H -0.558085 -1.945379 -1.857397
H -0.440862 0.327841 1.829763
H -0.149174 -1.405910 2.013379
H -2.830997 -1.177233 -1.024509
H -2.398806 -1.280936 2.623753
H -2.473485 -4.237400 -0.573182
H -3.986031 -3.406181 -0.903536
H -2.742206 -3.493676 -2.166838
H -4.144669 0.029523 1.462519
H -2.824463 1.150397 1.838814
H -3.047330 0.549135 0.192519
H 1.341897 -3.030880 0.251811
H 0.450822 3.656380 -1.416673
H -1.111195 2.857314 -1.819477
H 4.142867 1.086206 0.113052
H 3.804334 -3.203189 0.473427
H 5.219915 -1.153105 0.406877
H -0.247201 3.837732 1.021556
H -2.673490 4.455675 1.175778
H -2.972647 3.789310 -0.472896


%chk=000203047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203047

0 1
O -2.641240 -2.156300 0.919781
O -1.566490 0.581866 -1.650810
O 2.141437 2.700557 0.159103
N 0.202764 1.663982 -0.607925
C -0.182337 -0.791735 -0.131210
C -0.867826 -2.011311 -0.813420
C -0.673952 -0.708666 1.377405
C -2.386720 -2.123872 -0.541397
C -2.189918 -0.931525 1.617596
C 1.352101 -0.909905 -0.047528
C -0.572901 0.506135 -0.877726
C 2.132952 0.274287 0.063298
C -2.967121 -3.430569 -1.085436
C -3.109397 0.274245 1.337265
C 1.519688 1.624061 -0.078664
C 2.017532 -2.154877 0.064806
C -0.332394 3.002469 -1.019305
C 3.531872 0.212449 0.284715
C 3.413331 -2.218139 0.271159
C 4.177507 -1.033003 0.388254
C -0.948026 3.743405 0.152417
C -2.251080 4.112577 0.209370
H -0.414294 -2.942938 -0.430786
H -0.694058 -1.971379 -1.904715
H -0.352920 0.251135 1.824468
H -0.133265 -1.513801 1.909650
H -2.908674 -1.259383 -0.990437
H -2.304871 -1.206400 2.683343
H -2.472841 -4.300286 -0.615011
H -4.046271 -3.488449 -0.862954
H -2.830077 -3.492209 -2.180304
H -4.145896 0.007871 1.609041
H -2.801595 1.140930 1.951920
H -3.099180 0.589840 0.282255
H 1.455960 -3.090293 -0.004245
H 0.517406 3.578545 -1.425066
H -1.074550 2.819769 -1.811388
H 4.081642 1.155447 0.367151
H 3.903661 -3.195280 0.345050
H 5.258329 -1.084873 0.555068
H -0.257256 3.997261 0.967928
H -2.651006 4.672771 1.062400
H -2.953725 3.871585 -0.598213


