%chk=000267112.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267112

0 1
O 3.972112 -1.777458 -0.172012
N 4.230438 0.763236 -0.807712
C -1.254603 1.322626 0.774376
C 0.198444 1.173631 0.326898
C -2.079492 0.122755 0.294179
C -1.234905 1.450248 2.311094
C -1.931095 2.573829 0.176531
C 0.826136 -0.064233 0.410072
C 0.953106 2.283330 -0.120543
C -1.955198 -0.296652 -1.043086
C -2.985411 -0.543547 1.128810
C 2.174156 -0.259682 0.042200
C 2.274546 2.145626 -0.489387
C 2.913544 0.868683 -0.420293
C -2.711767 -1.364124 -1.527330
C -3.743273 -1.615203 0.642306
C 2.799406 -1.589415 0.131808
C -3.608889 -2.029780 -0.684070
C 1.976366 -2.753741 0.609103
H -2.230509 1.654007 2.717586
H -0.852840 0.539860 2.785217
H -0.580840 2.272881 2.623304
H -2.997270 2.599222 0.432187
H -1.485927 3.499168 0.554850
H -1.861635 2.584807 -0.916830
H 0.250502 -0.922204 0.771164
H 0.486334 3.269455 -0.172859
H -1.257534 0.215341 -1.706332
H -3.116143 -0.235012 2.164452
H 2.839105 3.007195 -0.833734
H -2.604959 -1.678899 -2.563950
H -4.442075 -2.124675 1.303412
H -4.198464 -2.862004 -1.061286
H 4.720301 -0.134912 -0.756382
H 4.749737 1.562713 -1.115923
H 1.098755 -2.925652 -0.027882
H 1.623046 -2.611422 1.638120
H 2.573494 -3.678995 0.596240


%chk=000267112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267112

0 1
O 4.095191 -1.778548 -0.091398
N 4.310705 0.751093 -0.780124
C -1.270561 1.323126 0.765697
C 0.197458 1.177521 0.289202
C -2.115145 0.119378 0.273838
C -1.248831 1.433685 2.319679
C -1.941460 2.615702 0.208440
C 0.858770 -0.058568 0.412456
C 0.961734 2.274116 -0.207559
C -2.100650 -0.220309 -1.107325
C -2.947939 -0.639261 1.133744
C 2.227228 -0.253801 0.065891
C 2.310670 2.133110 -0.559876
C 2.983576 0.878574 -0.432802
C -2.889888 -1.274912 -1.610646
C -3.740880 -1.700567 0.634333
C 2.859103 -1.581734 0.205939
C -3.717949 -2.023113 -0.739621
C 2.039340 -2.764873 0.713045
H -2.257929 1.630773 2.727683
H -0.852385 0.514158 2.786680
H -0.593564 2.270625 2.619593
H -3.004842 2.637523 0.505722
H -1.461410 3.525957 0.612611
H -1.897907 2.655167 -0.894485
H 0.287269 -0.917868 0.779264
H 0.494045 3.256989 -0.327477
H -1.448774 0.339215 -1.789100
H -2.985369 -0.411698 2.203723
H 2.869576 2.996232 -0.942308
H -2.858323 -1.516496 -2.679382
H -4.374544 -2.273567 1.321357
H -4.331095 -2.844454 -1.127281
H 4.731342 -0.184109 -0.664450
H 4.831572 1.549470 -1.135099
H 1.166682 -2.959993 0.063070
H 1.656351 -2.581949 1.734089
H 2.685533 -3.655592 0.727176


