%chk=000200306.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200306

0 1
O 1.306038 -0.747087 -1.532048
N -3.113384 0.947236 -0.213234
C -1.015492 -0.394594 -0.072226
C -1.415169 -0.212485 -1.569915
C -2.276698 0.109230 0.703412
C -0.756904 -1.887442 0.243607
C -2.826692 0.403603 -1.582747
C 0.247020 0.401274 0.228433
C -0.398145 -2.146625 1.712272
C -2.769670 2.396748 -0.111761
C 1.436810 0.193106 -0.525701
C 0.315973 1.340565 1.256599
C -0.155033 -3.631439 1.976284
C 2.618741 0.891840 -0.265226
C 1.491885 2.054274 1.533547
C 2.637042 1.829359 0.775105
C 2.470330 -1.050239 -2.336116
H -1.387958 -1.169863 -2.113095
H -0.695272 0.438838 -2.095042
H -2.912753 -0.753571 0.999954
H -2.026513 0.643183 1.638587
H 0.065376 -2.253043 -0.407741
H -1.647480 -2.481219 -0.036482
H -2.937867 1.173546 -2.366217
H -3.596803 -0.371840 -1.782257
H -1.204868 -1.778483 2.374720
H 0.505679 -1.565257 1.985068
H -3.409976 2.963219 -0.805834
H -1.718765 2.637958 -0.331661
H -3.004868 2.748999 0.904299
H -0.570920 1.529082 1.870895
H -1.043340 -4.232496 1.752160
H 0.666528 -4.019840 1.363890
H 0.105629 -3.808525 3.025529
H 3.517089 0.722793 -0.848495
H 1.502208 2.779665 2.342877
H 3.553337 2.379004 0.985588
H 3.269133 -1.460678 -1.711827
H 2.796518 -0.162543 -2.885333
H 2.076132 -1.812553 -3.020468


%chk=000200306-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200306

0 1
O 1.377059 -0.734135 -1.563579
N -3.132551 0.955136 -0.191589
C -1.003370 -0.358134 -0.051275
C -1.443858 -0.155007 -1.559294
C -2.299329 0.137752 0.728030
C -0.778231 -1.877671 0.260440
C -2.947125 0.258325 -1.496477
C 0.290815 0.433164 0.253665
C -0.458545 -2.194760 1.739529
C -2.769806 2.393476 -0.231641
C 1.478891 0.213053 -0.522018
C 0.399451 1.380423 1.300162
C -0.277522 -3.708527 1.985935
C 2.681282 0.911781 -0.258666
C 1.593990 2.086978 1.577686
C 2.739549 1.851531 0.794236
C 2.555393 -0.972384 -2.397768
H -1.283517 -1.073063 -2.149093
H -0.843199 0.642579 -2.028785
H -2.886267 -0.762870 0.996282
H -2.109061 0.684972 1.664010
H 0.039919 -2.258464 -0.377406
H -1.698984 -2.422697 -0.038013
H -3.256070 0.907399 -2.334201
H -3.593991 -0.641225 -1.505968
H -1.268218 -1.812062 2.393223
H 0.462965 -1.658107 2.038277
H -3.459740 2.918276 -0.916638
H -1.724475 2.604433 -0.559409
H -2.904844 2.827752 0.775276
H -0.472360 1.584412 1.927621
H -1.197880 -4.267319 1.729803
H 0.543271 -4.114232 1.364228
H -0.036613 -3.920922 3.044114
H 3.574366 0.730413 -0.863812
H 1.620755 2.810903 2.399037
H 3.673727 2.388496 0.992935
H 3.402556 -1.365602 -1.802217
H 2.871176 -0.051693 -2.926290
H 2.237289 -1.728679 -3.130949


