%chk=000202192.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202192

0 1
O -0.771234 2.225416 0.000825
O 0.421498 -2.236657 -0.000837
N -0.100434 0.002720 0.000251
N -2.445548 0.650180 0.000779
C 1.354777 0.430564 0.000080
C 2.054485 -0.084824 1.270905
C 2.053742 -0.083495 -1.271696
C 3.520594 0.367984 1.268557
C 3.519860 0.369289 -1.269742
C 4.245858 -0.101777 -0.001045
C -1.055677 1.040116 0.000771
C -0.460980 -1.403680 -0.000234
C -2.840390 -0.696698 0.000529
C -1.886692 -1.667614 0.000093
C -3.446583 1.746672 0.001050
C -4.299392 -1.004845 0.000728
H 1.369279 1.556507 0.000677
H 2.001461 -1.194595 1.308919
H 1.537387 0.281231 2.175128
H 1.536117 0.283510 -2.175232
H 2.000673 -1.193223 -1.310832
H 4.032926 -0.031181 2.164065
H 3.577080 1.470603 1.349426
H 3.576309 1.471991 -1.349516
H 4.031666 -0.028963 -2.165955
H 5.286678 0.270120 -0.001155
H 4.312220 -1.207776 -0.001632
H -2.148890 -2.726014 -0.000117
H -4.079282 1.702464 -0.900015
H -2.930150 2.731843 0.000924
H -4.078777 1.702451 0.902472
H -4.808383 -0.599199 -0.887688
H -4.808153 -0.599239 0.889292
H -4.486944 -2.091383 0.000726


%chk=000202192-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202192

0 1
O -0.721083 2.240411 0.000635
O 0.408460 -2.336834 -0.000060
N -0.121440 -0.035558 -0.000028
N -2.436964 0.647432 0.000517
C 1.333894 0.358334 -0.000076
C 2.058770 -0.112135 1.285000
C 2.058195 -0.110433 -1.286095
C 3.523466 0.391923 1.275326
C 3.522883 0.393631 -1.276404
C 4.269482 -0.066179 -0.001015
C -1.058331 1.019764 0.000085
C -0.478457 -1.429146 -0.000046
C -2.848719 -0.692472 0.000532
C -1.907534 -1.697459 0.000267
C -3.418941 1.754291 0.000966
C -4.331650 -0.979333 0.000874
H 1.315471 1.463528 0.000649
H 2.041802 -1.214789 1.335369
H 1.525363 0.277529 2.173474
H 1.524390 0.280407 -2.173813
H 2.041215 -1.213017 -1.337920
H 4.046419 0.023659 2.178889
H 3.536312 1.500760 1.326239
H 3.535690 1.502536 -1.325825
H 4.045437 0.026592 -2.180696
H 5.303363 0.330455 -0.000985
H 4.346476 -1.172588 -0.001772
H -2.208088 -2.745443 0.000330
H -4.056137 1.715318 -0.899372
H -2.849164 2.694611 0.000703
H -4.055323 1.715335 0.901885
H -4.831285 -0.555775 -0.889926
H -4.830911 -0.555697 0.891845
H -4.497957 -2.067161 0.000952


