%chk=000212646.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212646

0 1
O -1.503220 -1.934888 0.958566
O -3.036669 1.059027 -0.312355
N -0.584967 0.077544 0.355221
C 1.731784 -0.297504 -0.659566
C 3.163070 -0.233971 0.019821
C 2.795170 1.062635 0.835657
C 0.807635 -0.338125 0.620608
C 1.621650 1.120490 -1.299973
C 1.523298 0.631067 1.611640
C 2.333467 2.043923 -0.277190
C 1.477080 -1.434399 -1.619716
C 3.510454 -1.440366 0.896032
C 4.320815 -0.036999 -0.962291
C -1.648357 -0.796354 0.537834
C -2.986593 -0.253473 0.202101
C -4.252089 -0.778533 0.286208
C -5.155921 0.236251 -0.193067
C -4.388127 1.317981 -0.540562
H 3.594212 1.453610 1.473168
H 0.785539 -1.380954 1.034256
H 0.581791 1.420447 -1.484463
H 2.118750 1.144122 -2.282294
H 1.772888 0.120382 2.553947
H 0.898647 1.491997 1.891803
H 3.189152 2.568401 -0.728217
H 1.663039 2.821786 0.114685
H 2.173900 -1.414193 -2.465279
H 1.587330 -2.410381 -1.129511
H 0.458884 -1.395004 -2.026837
H 2.734466 -1.692691 1.625727
H 3.668890 -2.335904 0.283774
H 4.431530 -1.260213 1.461438
H 4.159297 0.788784 -1.661665
H 5.254281 0.172433 -0.428356
H 4.479276 -0.938240 -1.565490
H -0.728014 1.013263 -0.021023
H -4.527967 -1.757534 0.639925
H -6.223036 0.135571 -0.254628
H -4.565335 2.293914 -0.936327


%chk=000212646-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212646

0 1
O -1.470279 -2.054908 0.729416
O -3.108451 1.098870 -0.161011
N -0.598869 0.093792 0.344585
C 1.740152 -0.275917 -0.660779
C 3.164278 -0.233111 0.042238
C 2.839208 1.093464 0.823085
C 0.800343 -0.257943 0.606022
C 1.668319 1.140932 -1.320538
C 1.529458 0.733441 1.585699
C 2.440206 2.074603 -0.319155
C 1.448799 -1.432461 -1.619371
C 3.474325 -1.442393 0.960750
C 4.347745 -0.108401 -0.947784
C -1.630289 -0.826322 0.434168
C -2.980690 -0.279695 0.162612
C -4.236265 -0.868358 0.158040
C -5.193068 0.161648 -0.177160
C -4.478895 1.334804 -0.362926
H 3.648982 1.464942 1.474589
H 0.757080 -1.277723 1.025311
H 0.623757 1.459357 -1.493044
H 2.150016 1.124427 -2.314870
H 1.723467 0.255260 2.561377
H 0.917529 1.633218 1.783113
H 3.327581 2.530166 -0.793318
H 1.814781 2.902929 0.061842
H 2.139515 -1.423857 -2.483680
H 1.534918 -2.412057 -1.114162
H 0.418101 -1.362565 -2.014823
H 2.736827 -1.596344 1.765402
H 3.522797 -2.376668 0.370144
H 4.461874 -1.305572 1.441056
H 4.218595 0.692004 -1.695114
H 5.284961 0.096845 -0.395918
H 4.490566 -1.057775 -1.497729
H -0.839815 1.060371 0.112513
H -4.430588 -1.916445 0.372879
H -6.271199 0.046525 -0.268278
H -4.749773 2.354818 -0.621582


